USER MOD reduce.3.24.130724 H: found=0, std=0, add=1495, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1491 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 154 ASN :FLIP amide:sc= -0.0288 F(o=-2!,f=-0.57) USER MOD Set 1.2: A 158 ASN :FLIP amide:sc= -0.538 X(o=-0.6,f=-0.57) USER MOD Set 2.1: A 27 HIS : no HE2:sc= 0.393 K(o=0.83,f=0) USER MOD Set 2.2: A 93 TYR OH : rot 167:sc= 0.434 USER MOD Set 3.1: A 20 HIS : no HE2:sc= -4.61! C(o=-3.9!,f=-12!) USER MOD Set 3.2: A 38 CYS SG : rot 63:sc= 0.658 USER MOD Set 4.1: A 19 HIS :FLIP no HD1:sc= -0.643 F(o=-1.9,f=-0.64) USER MOD Set 4.2: A 119 TYR OH : rot 30:sc= 0 USER MOD Single : A 13 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 15 LYS NZ :NH3+ -161:sc= -0.0197 (180deg=-0.39) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.0554 K(o=-0.055,f=-3!) USER MOD Single : A 23 THR OG1 : rot 76:sc= 0.707 USER MOD Single : A 25 GLN : amide:sc= -0.182 X(o=-0.18,f=-0.23) USER MOD Single : A 29 LYS NZ :NH3+ 141:sc= -0.697 (180deg=-2.32!) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 130:sc= -0.102 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN :FLIP amide:sc= -1.01 F(o=-2.6,f=-1) USER MOD Single : A 45 THR OG1 : rot 85:sc= 1.13 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 3:sc= 1.17 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.706 USER MOD Single : A 56 CYS SG : rot -91:sc= -2.79! USER MOD Single : A 58 LYS NZ :NH3+ 156:sc= -0.0745 (180deg=-0.532) USER MOD Single : A 61 SER OG : rot 82:sc= 1.31 USER MOD Single : A 62 LYS NZ :NH3+ 164:sc= -0.0113 (180deg=-0.302) USER MOD Single : A 64 MET CE :methyl -157:sc= -0.673 (180deg=-1.36) USER MOD Single : A 66 GLN : amide:sc= -0.802 K(o=-0.8,f=-4.6!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.107) USER MOD Single : A 73 GLN : amide:sc= -0.13 K(o=-0.13,f=-1.5!) USER MOD Single : A 77 ASN : amide:sc= -2.1! C(o=-2.1!,f=-15!) USER MOD Single : A 81 THR OG1 : rot -96:sc= 0.114 USER MOD Single : A 82 GLN : amide:sc= -0.267 X(o=-0.27,f=-0.37) USER MOD Single : A 87 CYS SG : rot 80:sc= 1.28 USER MOD Single : A 89 HIS : no HE2:sc= -1.78 K(o=-1.8,f=-4.9!) USER MOD Single : A 92 ASN :FLIP amide:sc= -0.674 F(o=-1.7!,f=-0.67) USER MOD Single : A 96 LYS NZ :NH3+ -141:sc= -2.16! (180deg=-2.52!) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 TYR OH : rot -110:sc= 0.324 USER MOD Single : A 103 ASN : amide:sc= -0.0146 K(o=-0.015,f=-0.83) USER MOD Single : A 111 HIS : no HD1:sc= -1.75 K(o=-1.8,f=-2.7) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= -5.31! C(o=-5.3!,f=-6!) USER MOD Single : A 114 MET CE :methyl -115:sc= -1.06 (180deg=-2.19) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 73:sc= 0.508 USER MOD Single : A 120 THR OG1 : rot 82:sc= 1 USER MOD Single : A 122 SER OG : rot -59:sc= 0.439 USER MOD Single : A 129 THR OG1 : rot -46:sc= 0.604 USER MOD Single : A 135 THR OG1 : rot 180:sc= -0.172 USER MOD Single : A 138 ASN :FLIP amide:sc= -0.698 F(o=-2.3,f=-0.7) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 HIS : no HD1:sc= -0.0939 X(o=-0.094,f=-0.0053) USER MOD Single : A 143 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0286) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 176:sc= -0.631! (180deg=-0.962!) USER MOD Single : A 150 THR OG1 : rot -81:sc= -0.0047 USER MOD Single : A 151 TYR OH : rot 30:sc= 0 USER MOD Single : A 153 HIS : no HE2:sc= -3.76! C(o=-3.8!,f=-4.7!) USER MOD Single : A 155 CYS SG : rot -38:sc= -0.45 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 THR OG1 : rot 180:sc= 0 USER MOD Single : A 163 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 155 THR OG1 : rot 180:sc= 0.0131 USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 37 N LEU A 4 8.246 15.024 -10.447 1.00 0.00 N ATOM 38 CA LEU A 4 8.321 14.351 -11.744 1.00 0.00 C ATOM 39 C LEU A 4 7.115 14.709 -12.601 1.00 0.00 C ATOM 40 O LEU A 4 6.083 15.146 -12.093 1.00 0.00 O ATOM 41 CB LEU A 4 8.373 12.836 -11.543 1.00 0.00 C ATOM 42 CG LEU A 4 9.711 12.434 -10.902 1.00 0.00 C ATOM 43 CD1 LEU A 4 9.617 10.979 -10.411 1.00 0.00 C ATOM 44 CD2 LEU A 4 10.869 12.585 -11.914 1.00 0.00 C ATOM 0 HA LEU A 4 9.226 14.682 -12.253 1.00 0.00 H new ATOM 0 HB2 LEU A 4 7.546 12.517 -10.908 1.00 0.00 H new ATOM 0 HB3 LEU A 4 8.253 12.330 -12.501 1.00 0.00 H new ATOM 0 HG LEU A 4 9.915 13.092 -10.057 1.00 0.00 H new ATOM 0 HD11 LEU A 4 10.563 10.687 -9.955 1.00 0.00 H new ATOM 0 HD12 LEU A 4 8.818 10.894 -9.675 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.403 10.323 -11.255 1.00 0.00 H new ATOM 0 HD21 LEU A 4 11.807 12.295 -11.440 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.685 11.944 -12.776 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.933 13.623 -12.241 1.00 0.00 H new ATOM 56 N ALA A 5 7.255 14.524 -13.908 1.00 0.00 N ATOM 57 CA ALA A 5 6.171 14.831 -14.829 1.00 0.00 C ATOM 58 C ALA A 5 4.963 13.924 -14.560 1.00 0.00 C ATOM 59 O ALA A 5 5.110 12.828 -14.015 1.00 0.00 O ATOM 60 CB ALA A 5 6.660 14.664 -16.281 1.00 0.00 C ATOM 0 H ALA A 5 8.102 14.166 -14.350 1.00 0.00 H new ATOM 0 HA ALA A 5 5.859 15.864 -14.677 1.00 0.00 H new ATOM 0 HB1 ALA A 5 5.846 14.895 -16.968 1.00 0.00 H new ATOM 0 HB2 ALA A 5 7.493 15.343 -16.465 1.00 0.00 H new ATOM 0 HB3 ALA A 5 6.988 13.636 -16.439 1.00 0.00 H new ATOM 66 N PRO A 6 3.782 14.353 -14.934 1.00 0.00 N ATOM 67 CA PRO A 6 2.534 13.558 -14.735 1.00 0.00 C ATOM 68 C PRO A 6 2.486 12.354 -15.670 1.00 0.00 C ATOM 69 O PRO A 6 2.936 12.427 -16.815 1.00 0.00 O ATOM 70 CB PRO A 6 1.410 14.558 -15.050 1.00 0.00 C ATOM 71 CG PRO A 6 2.026 15.542 -15.990 1.00 0.00 C ATOM 72 CD PRO A 6 3.505 15.644 -15.591 1.00 0.00 C ATOM 0 HA PRO A 6 2.457 13.142 -13.730 1.00 0.00 H new ATOM 0 HB2 PRO A 6 0.553 14.060 -15.504 1.00 0.00 H new ATOM 0 HB3 PRO A 6 1.051 15.047 -14.145 1.00 0.00 H new ATOM 0 HG2 PRO A 6 1.923 15.211 -17.023 1.00 0.00 H new ATOM 0 HG3 PRO A 6 1.535 16.512 -15.916 1.00 0.00 H new ATOM 0 HD2 PRO A 6 4.144 15.796 -16.461 1.00 0.00 H new ATOM 0 HD3 PRO A 6 3.680 16.482 -14.916 1.00 0.00 H new ATOM 80 N LEU A 7 1.940 11.245 -15.183 1.00 0.00 N ATOM 81 CA LEU A 7 1.847 10.035 -15.995 1.00 0.00 C ATOM 82 C LEU A 7 0.495 9.968 -16.710 1.00 0.00 C ATOM 83 O LEU A 7 -0.516 10.422 -16.175 1.00 0.00 O ATOM 84 CB LEU A 7 2.016 8.796 -15.109 1.00 0.00 C ATOM 85 CG LEU A 7 3.486 8.665 -14.660 1.00 0.00 C ATOM 86 CD1 LEU A 7 3.551 7.928 -13.318 1.00 0.00 C ATOM 87 CD2 LEU A 7 4.293 7.878 -15.705 1.00 0.00 C ATOM 0 H LEU A 7 1.559 11.157 -14.241 1.00 0.00 H new ATOM 0 HA LEU A 7 2.641 10.061 -16.742 1.00 0.00 H new ATOM 0 HB2 LEU A 7 1.366 8.871 -14.237 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.713 7.903 -15.656 1.00 0.00 H new ATOM 0 HG LEU A 7 3.910 9.664 -14.555 1.00 0.00 H new ATOM 0 HD11 LEU A 7 4.590 7.837 -13.003 1.00 0.00 H new ATOM 0 HD12 LEU A 7 2.992 8.488 -12.568 1.00 0.00 H new ATOM 0 HD13 LEU A 7 3.116 6.934 -13.427 1.00 0.00 H new ATOM 0 HD21 LEU A 7 5.329 7.793 -15.376 1.00 0.00 H new ATOM 0 HD22 LEU A 7 3.866 6.882 -15.820 1.00 0.00 H new ATOM 0 HD23 LEU A 7 4.258 8.401 -16.661 1.00 0.00 H new ATOM 99 N PRO A 8 0.453 9.411 -17.899 1.00 0.00 N ATOM 100 CA PRO A 8 -0.816 9.288 -18.681 1.00 0.00 C ATOM 101 C PRO A 8 -1.786 8.280 -18.062 1.00 0.00 C ATOM 102 O PRO A 8 -1.396 7.470 -17.216 1.00 0.00 O ATOM 103 CB PRO A 8 -0.341 8.819 -20.068 1.00 0.00 C ATOM 104 CG PRO A 8 0.967 8.134 -19.825 1.00 0.00 C ATOM 105 CD PRO A 8 1.603 8.842 -18.631 1.00 0.00 C ATOM 0 HA PRO A 8 -1.372 10.225 -18.709 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.063 8.140 -20.522 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -0.223 9.662 -20.749 1.00 0.00 H new ATOM 0 HG2 PRO A 8 0.819 7.075 -19.616 1.00 0.00 H new ATOM 0 HG3 PRO A 8 1.609 8.198 -20.703 1.00 0.00 H new ATOM 0 HD2 PRO A 8 2.168 8.147 -18.009 1.00 0.00 H new ATOM 0 HD3 PRO A 8 2.297 9.619 -18.951 1.00 0.00 H new ATOM 113 N PRO A 9 -3.032 8.309 -18.474 1.00 0.00 N ATOM 114 CA PRO A 9 -4.072 7.370 -17.962 1.00 0.00 C ATOM 115 C PRO A 9 -3.601 5.927 -18.084 1.00 0.00 C ATOM 116 O PRO A 9 -3.165 5.498 -19.152 1.00 0.00 O ATOM 117 CB PRO A 9 -5.298 7.644 -18.861 1.00 0.00 C ATOM 118 CG PRO A 9 -4.778 8.449 -20.014 1.00 0.00 C ATOM 119 CD PRO A 9 -3.595 9.236 -19.464 1.00 0.00 C ATOM 0 HA PRO A 9 -4.296 7.518 -16.905 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -5.749 6.713 -19.204 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -6.069 8.190 -18.317 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -4.471 7.803 -20.836 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -5.546 9.117 -20.404 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -2.875 9.484 -20.243 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -3.909 10.175 -19.009 1.00 0.00 H new ATOM 127 N LEU A 10 -3.677 5.182 -16.990 1.00 0.00 N ATOM 128 CA LEU A 10 -3.235 3.797 -16.999 1.00 0.00 C ATOM 129 C LEU A 10 -4.386 2.850 -17.377 1.00 0.00 C ATOM 130 O LEU A 10 -5.467 2.945 -16.799 1.00 0.00 O ATOM 131 CB LEU A 10 -2.710 3.418 -15.614 1.00 0.00 C ATOM 132 CG LEU A 10 -3.799 3.655 -14.527 1.00 0.00 C ATOM 133 CD1 LEU A 10 -4.337 2.320 -13.995 1.00 0.00 C ATOM 134 CD2 LEU A 10 -3.197 4.438 -13.354 1.00 0.00 C ATOM 0 H LEU A 10 -4.037 5.510 -16.094 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.444 3.698 -17.742 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.406 2.371 -15.609 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.823 4.008 -15.382 1.00 0.00 H new ATOM 0 HG LEU A 10 -4.614 4.218 -14.982 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -5.097 2.510 -13.237 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -4.777 1.752 -14.815 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.520 1.748 -13.555 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -3.962 4.602 -12.595 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.373 3.870 -12.922 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -2.827 5.400 -13.710 1.00 0.00 H new ATOM 146 N PRO A 11 -4.181 1.929 -18.301 1.00 0.00 N ATOM 147 CA PRO A 11 -5.241 0.945 -18.704 1.00 0.00 C ATOM 148 C PRO A 11 -5.922 0.290 -17.499 1.00 0.00 C ATOM 149 O PRO A 11 -5.331 0.170 -16.429 1.00 0.00 O ATOM 150 CB PRO A 11 -4.474 -0.108 -19.518 1.00 0.00 C ATOM 151 CG PRO A 11 -3.270 0.599 -20.053 1.00 0.00 C ATOM 152 CD PRO A 11 -2.940 1.732 -19.076 1.00 0.00 C ATOM 0 HA PRO A 11 -6.045 1.429 -19.259 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -4.187 -0.954 -18.894 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -5.089 -0.503 -20.327 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.429 -0.088 -20.144 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -3.467 0.995 -21.049 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -2.106 1.466 -18.427 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -2.655 2.641 -19.605 1.00 0.00 H new ATOM 160 N ALA A 12 -7.168 -0.137 -17.692 1.00 0.00 N ATOM 161 CA ALA A 12 -7.923 -0.780 -16.618 1.00 0.00 C ATOM 162 C ALA A 12 -7.162 -1.981 -16.070 1.00 0.00 C ATOM 163 O ALA A 12 -7.383 -2.400 -14.938 1.00 0.00 O ATOM 164 CB ALA A 12 -9.287 -1.234 -17.140 1.00 0.00 C ATOM 0 H ALA A 12 -7.673 -0.051 -18.574 1.00 0.00 H new ATOM 0 HA ALA A 12 -8.062 -0.057 -15.815 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -9.844 -1.712 -16.334 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -9.844 -0.370 -17.503 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -9.147 -1.944 -17.955 1.00 0.00 H new ATOM 170 N GLN A 13 -6.267 -2.535 -16.875 1.00 0.00 N ATOM 171 CA GLN A 13 -5.486 -3.690 -16.448 1.00 0.00 C ATOM 172 C GLN A 13 -4.615 -3.336 -15.239 1.00 0.00 C ATOM 173 O GLN A 13 -4.291 -4.197 -14.421 1.00 0.00 O ATOM 174 CB GLN A 13 -4.605 -4.170 -17.603 1.00 0.00 C ATOM 175 CG GLN A 13 -5.494 -4.727 -18.716 1.00 0.00 C ATOM 176 CD GLN A 13 -4.650 -5.077 -19.937 1.00 0.00 C ATOM 177 OE1 GLN A 13 -3.349 -5.056 -19.845 1.00 0.00 O flip ATOM 178 NE2 GLN A 13 -5.190 -5.379 -21.001 1.00 0.00 N flip ATOM 0 H GLN A 13 -6.064 -2.208 -17.820 1.00 0.00 H new ATOM 0 HA GLN A 13 -6.170 -4.487 -16.158 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -4.001 -3.346 -17.982 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -3.914 -4.938 -17.254 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -6.020 -5.614 -18.362 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -6.253 -3.993 -18.987 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -6.208 -5.395 -21.070 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -4.620 -5.614 -21.814 1.00 0.00 H new ATOM 187 N PHE A 14 -4.233 -2.061 -15.142 1.00 0.00 N ATOM 188 CA PHE A 14 -3.388 -1.589 -14.042 1.00 0.00 C ATOM 189 C PHE A 14 -4.224 -0.895 -12.975 1.00 0.00 C ATOM 190 O PHE A 14 -3.699 -0.199 -12.103 1.00 0.00 O ATOM 191 CB PHE A 14 -2.321 -0.641 -14.596 1.00 0.00 C ATOM 192 CG PHE A 14 -1.436 -1.345 -15.629 1.00 0.00 C ATOM 193 CD1 PHE A 14 -1.235 -2.747 -15.623 1.00 0.00 C ATOM 194 CD2 PHE A 14 -0.814 -0.569 -16.617 1.00 0.00 C ATOM 195 CE1 PHE A 14 -0.417 -3.342 -16.600 1.00 0.00 C ATOM 196 CE2 PHE A 14 -0.004 -1.173 -17.590 1.00 0.00 C ATOM 197 CZ PHE A 14 0.193 -2.555 -17.581 1.00 0.00 C ATOM 0 H PHE A 14 -4.495 -1.337 -15.811 1.00 0.00 H new ATOM 0 HA PHE A 14 -2.901 -2.444 -13.574 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.802 0.224 -15.054 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -1.704 -0.267 -13.779 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.709 -3.358 -14.869 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -0.959 0.501 -16.629 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -0.260 -4.410 -16.592 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.469 -0.567 -18.349 1.00 0.00 H new ATOM 0 HZ PHE A 14 0.817 -3.016 -18.332 1.00 0.00 H new ATOM 207 N LYS A 15 -5.524 -1.110 -13.038 1.00 0.00 N ATOM 208 CA LYS A 15 -6.425 -0.535 -12.062 1.00 0.00 C ATOM 209 C LYS A 15 -6.027 -0.999 -10.662 1.00 0.00 C ATOM 210 O LYS A 15 -6.304 -0.327 -9.675 1.00 0.00 O ATOM 211 CB LYS A 15 -7.865 -0.968 -12.364 1.00 0.00 C ATOM 212 CG LYS A 15 -8.034 -2.474 -12.113 1.00 0.00 C ATOM 213 CD LYS A 15 -9.447 -2.900 -12.518 1.00 0.00 C ATOM 214 CE LYS A 15 -9.622 -4.396 -12.247 1.00 0.00 C ATOM 215 NZ LYS A 15 -8.736 -5.170 -13.161 1.00 0.00 N ATOM 0 H LYS A 15 -5.978 -1.678 -13.754 1.00 0.00 H new ATOM 0 HA LYS A 15 -6.363 0.552 -12.112 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -8.559 -0.408 -11.737 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -8.112 -0.735 -13.400 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -7.295 -3.035 -12.685 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -7.861 -2.700 -11.061 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -10.186 -2.328 -11.957 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -9.614 -2.688 -13.574 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -9.377 -4.620 -11.209 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -10.662 -4.685 -12.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -9.069 -6.153 -13.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -8.757 -4.743 -14.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -7.762 -5.155 -12.796 1.00 0.00 H new ATOM 229 N SER A 16 -5.393 -2.172 -10.582 1.00 0.00 N ATOM 230 CA SER A 16 -4.983 -2.718 -9.288 1.00 0.00 C ATOM 231 C SER A 16 -3.862 -1.891 -8.663 1.00 0.00 C ATOM 232 O SER A 16 -3.924 -1.531 -7.487 1.00 0.00 O ATOM 233 CB SER A 16 -4.507 -4.162 -9.460 1.00 0.00 C ATOM 234 OG SER A 16 -4.199 -4.709 -8.184 1.00 0.00 O ATOM 0 H SER A 16 -5.156 -2.754 -11.386 1.00 0.00 H new ATOM 0 HA SER A 16 -5.847 -2.685 -8.624 1.00 0.00 H new ATOM 0 HB2 SER A 16 -5.280 -4.757 -9.947 1.00 0.00 H new ATOM 0 HB3 SER A 16 -3.628 -4.193 -10.104 1.00 0.00 H new ATOM 0 HG SER A 16 -3.895 -5.635 -8.290 1.00 0.00 H new ATOM 240 N ILE A 17 -2.835 -1.602 -9.458 1.00 0.00 N ATOM 241 CA ILE A 17 -1.696 -0.830 -8.975 1.00 0.00 C ATOM 242 C ILE A 17 -2.056 0.643 -8.891 1.00 0.00 C ATOM 243 O ILE A 17 -1.316 1.444 -8.321 1.00 0.00 O ATOM 244 CB ILE A 17 -0.492 -1.022 -9.910 1.00 0.00 C ATOM 245 CG1 ILE A 17 -0.869 -0.603 -11.339 1.00 0.00 C ATOM 246 CG2 ILE A 17 -0.081 -2.491 -9.924 1.00 0.00 C ATOM 247 CD1 ILE A 17 0.362 -0.658 -12.266 1.00 0.00 C ATOM 0 H ILE A 17 -2.769 -1.889 -10.434 1.00 0.00 H new ATOM 0 HA ILE A 17 -1.432 -1.185 -7.979 1.00 0.00 H new ATOM 0 HB ILE A 17 0.334 -0.408 -9.550 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -1.649 -1.261 -11.722 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -1.279 0.407 -11.331 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.773 -2.624 -10.588 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.192 -2.802 -8.916 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.914 -3.098 -10.278 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.073 -0.358 -13.273 1.00 0.00 H new ATOM 0 HD12 ILE A 17 1.130 0.019 -11.892 1.00 0.00 H new ATOM 0 HD13 ILE A 17 0.755 -1.675 -12.289 1.00 0.00 H new ATOM 259 N GLN A 18 -3.193 0.998 -9.471 1.00 0.00 N ATOM 260 CA GLN A 18 -3.631 2.382 -9.464 1.00 0.00 C ATOM 261 C GLN A 18 -3.593 2.942 -8.050 1.00 0.00 C ATOM 262 O GLN A 18 -3.118 4.054 -7.827 1.00 0.00 O ATOM 263 CB GLN A 18 -5.048 2.476 -10.025 1.00 0.00 C ATOM 264 CG GLN A 18 -5.506 3.929 -10.021 1.00 0.00 C ATOM 265 CD GLN A 18 -6.794 4.073 -10.828 1.00 0.00 C ATOM 266 OE1 GLN A 18 -7.012 3.329 -11.786 1.00 0.00 O ATOM 267 NE2 GLN A 18 -7.667 4.986 -10.500 1.00 0.00 N ATOM 0 H GLN A 18 -3.822 0.352 -9.948 1.00 0.00 H new ATOM 0 HA GLN A 18 -2.957 2.969 -10.088 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -5.075 2.079 -11.040 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -5.727 1.869 -9.427 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -5.669 4.265 -8.997 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -4.729 4.565 -10.445 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -7.487 5.602 -9.707 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -8.529 5.083 -11.036 1.00 0.00 H new ATOM 276 N HIS A 19 -4.092 2.168 -7.096 1.00 0.00 N ATOM 277 CA HIS A 19 -4.105 2.610 -5.709 1.00 0.00 C ATOM 278 C HIS A 19 -2.679 2.758 -5.191 1.00 0.00 C ATOM 279 O HIS A 19 -2.363 3.709 -4.475 1.00 0.00 O ATOM 280 CB HIS A 19 -4.850 1.585 -4.852 1.00 0.00 C ATOM 281 CG HIS A 19 -6.133 1.205 -5.536 1.00 0.00 C ATOM 282 ND1 HIS A 19 -6.863 1.818 -6.523 1.00 0.00 N flip ATOM 283 CD2 HIS A 19 -6.816 0.039 -5.229 1.00 0.00 C flip ATOM 284 CE1 HIS A 19 -7.982 1.051 -6.826 1.00 0.00 C flip ATOM 285 NE2 HIS A 19 -7.905 -0.011 -6.018 1.00 0.00 N flip ATOM 0 H HIS A 19 -4.489 1.242 -7.254 1.00 0.00 H new ATOM 0 HA HIS A 19 -4.609 3.575 -5.651 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -4.230 0.702 -4.700 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -5.059 2.001 -3.866 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -6.527 -0.695 -4.492 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -8.748 1.267 -7.556 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -8.589 -0.768 -6.001 1.00 0.00 H new ATOM 293 N HIS A 20 -1.824 1.811 -5.560 1.00 0.00 N ATOM 294 CA HIS A 20 -0.432 1.844 -5.128 1.00 0.00 C ATOM 295 C HIS A 20 0.262 3.090 -5.670 1.00 0.00 C ATOM 296 O HIS A 20 1.025 3.747 -4.963 1.00 0.00 O ATOM 297 CB HIS A 20 0.302 0.575 -5.610 1.00 0.00 C ATOM 298 CG HIS A 20 1.436 0.249 -4.670 1.00 0.00 C ATOM 299 ND1 HIS A 20 2.213 1.231 -4.078 1.00 0.00 N ATOM 300 CD2 HIS A 20 1.924 -0.948 -4.200 1.00 0.00 C ATOM 301 CE1 HIS A 20 3.114 0.616 -3.291 1.00 0.00 C ATOM 302 NE2 HIS A 20 2.984 -0.712 -3.331 1.00 0.00 N ATOM 0 H HIS A 20 -2.067 1.017 -6.152 1.00 0.00 H new ATOM 0 HA HIS A 20 -0.405 1.876 -4.039 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -0.394 -0.262 -5.658 1.00 0.00 H new ATOM 0 HB3 HIS A 20 0.687 0.728 -6.618 1.00 0.00 H new ATOM 0 HD1 HIS A 20 2.119 2.238 -4.214 1.00 0.00 H new ATOM 0 HD2 HIS A 20 1.542 -1.923 -4.465 1.00 0.00 H new ATOM 0 HE1 HIS A 20 3.853 1.134 -2.698 1.00 0.00 H new ATOM 310 N LEU A 21 -0.008 3.405 -6.929 1.00 0.00 N ATOM 311 CA LEU A 21 0.596 4.569 -7.563 1.00 0.00 C ATOM 312 C LEU A 21 0.153 5.850 -6.865 1.00 0.00 C ATOM 313 O LEU A 21 0.951 6.763 -6.653 1.00 0.00 O ATOM 314 CB LEU A 21 0.188 4.623 -9.037 1.00 0.00 C ATOM 315 CG LEU A 21 0.785 3.423 -9.790 1.00 0.00 C ATOM 316 CD1 LEU A 21 0.173 3.349 -11.191 1.00 0.00 C ATOM 317 CD2 LEU A 21 2.315 3.556 -9.907 1.00 0.00 C ATOM 0 H LEU A 21 -0.638 2.874 -7.530 1.00 0.00 H new ATOM 0 HA LEU A 21 1.680 4.484 -7.485 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -0.899 4.613 -9.123 1.00 0.00 H new ATOM 0 HB3 LEU A 21 0.535 5.554 -9.485 1.00 0.00 H new ATOM 0 HG LEU A 21 0.557 2.514 -9.233 1.00 0.00 H new ATOM 0 HD11 LEU A 21 0.594 2.499 -11.728 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -0.907 3.228 -11.110 1.00 0.00 H new ATOM 0 HD13 LEU A 21 0.395 4.267 -11.734 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.715 2.696 -10.443 1.00 0.00 H new ATOM 0 HD22 LEU A 21 2.560 4.468 -10.450 1.00 0.00 H new ATOM 0 HD23 LEU A 21 2.754 3.598 -8.910 1.00 0.00 H new ATOM 329 N ARG A 22 -1.127 5.910 -6.518 1.00 0.00 N ATOM 330 CA ARG A 22 -1.670 7.086 -5.854 1.00 0.00 C ATOM 331 C ARG A 22 -0.972 7.297 -4.510 1.00 0.00 C ATOM 332 O ARG A 22 -0.604 8.418 -4.159 1.00 0.00 O ATOM 333 CB ARG A 22 -3.193 6.898 -5.652 1.00 0.00 C ATOM 334 CG ARG A 22 -3.955 8.181 -6.030 1.00 0.00 C ATOM 335 CD ARG A 22 -4.116 8.261 -7.554 1.00 0.00 C ATOM 336 NE ARG A 22 -4.976 9.385 -7.907 1.00 0.00 N ATOM 337 CZ ARG A 22 -4.488 10.613 -8.046 1.00 0.00 C ATOM 338 NH1 ARG A 22 -3.216 10.836 -7.859 1.00 0.00 N ATOM 339 NH2 ARG A 22 -5.286 11.594 -8.367 1.00 0.00 N ATOM 0 H ARG A 22 -1.803 5.164 -6.684 1.00 0.00 H new ATOM 0 HA ARG A 22 -1.498 7.968 -6.471 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -3.546 6.067 -6.262 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.398 6.640 -4.613 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.934 8.188 -5.551 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -3.416 9.056 -5.666 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -3.140 8.377 -8.025 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -4.544 7.332 -7.932 1.00 0.00 H new ATOM 0 HE ARG A 22 -5.973 9.225 -8.050 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -2.595 10.067 -7.606 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -2.842 11.779 -7.966 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -6.280 11.417 -8.510 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -4.916 12.538 -8.475 1.00 0.00 H new ATOM 353 N THR A 23 -0.791 6.211 -3.771 1.00 0.00 N ATOM 354 CA THR A 23 -0.137 6.288 -2.475 1.00 0.00 C ATOM 355 C THR A 23 1.285 6.812 -2.625 1.00 0.00 C ATOM 356 O THR A 23 1.732 7.658 -1.852 1.00 0.00 O ATOM 357 CB THR A 23 -0.113 4.905 -1.819 1.00 0.00 C ATOM 358 OG1 THR A 23 -1.412 4.337 -1.874 1.00 0.00 O ATOM 359 CG2 THR A 23 0.328 5.038 -0.361 1.00 0.00 C ATOM 0 H THR A 23 -1.086 5.274 -4.045 1.00 0.00 H new ATOM 0 HA THR A 23 -0.699 6.976 -1.844 1.00 0.00 H new ATOM 0 HB THR A 23 0.588 4.261 -2.350 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.589 4.012 -2.781 1.00 0.00 H new ATOM 0 HG21 THR A 23 0.345 4.053 0.105 1.00 0.00 H new ATOM 0 HG22 THR A 23 1.326 5.475 -0.321 1.00 0.00 H new ATOM 0 HG23 THR A 23 -0.372 5.681 0.174 1.00 0.00 H new ATOM 367 N ALA A 24 1.994 6.305 -3.625 1.00 0.00 N ATOM 368 CA ALA A 24 3.368 6.731 -3.860 1.00 0.00 C ATOM 369 C ALA A 24 3.443 8.247 -4.017 1.00 0.00 C ATOM 370 O ALA A 24 4.263 8.906 -3.381 1.00 0.00 O ATOM 371 CB ALA A 24 3.906 6.064 -5.126 1.00 0.00 C ATOM 0 H ALA A 24 1.646 5.605 -4.280 1.00 0.00 H new ATOM 0 HA ALA A 24 3.972 6.436 -3.002 1.00 0.00 H new ATOM 0 HB1 ALA A 24 4.933 6.385 -5.298 1.00 0.00 H new ATOM 0 HB2 ALA A 24 3.880 4.981 -5.006 1.00 0.00 H new ATOM 0 HB3 ALA A 24 3.289 6.350 -5.978 1.00 0.00 H new ATOM 377 N GLN A 25 2.579 8.795 -4.864 1.00 0.00 N ATOM 378 CA GLN A 25 2.563 10.235 -5.092 1.00 0.00 C ATOM 379 C GLN A 25 2.366 10.983 -3.775 1.00 0.00 C ATOM 380 O GLN A 25 3.030 11.987 -3.516 1.00 0.00 O ATOM 381 CB GLN A 25 1.434 10.593 -6.060 1.00 0.00 C ATOM 382 CG GLN A 25 1.770 10.068 -7.458 1.00 0.00 C ATOM 383 CD GLN A 25 2.927 10.868 -8.051 1.00 0.00 C ATOM 384 OE1 GLN A 25 2.839 12.090 -8.170 1.00 0.00 O ATOM 385 NE2 GLN A 25 4.013 10.250 -8.428 1.00 0.00 N ATOM 0 H GLN A 25 1.887 8.270 -5.399 1.00 0.00 H new ATOM 0 HA GLN A 25 3.520 10.530 -5.523 1.00 0.00 H new ATOM 0 HB2 GLN A 25 0.495 10.161 -5.715 1.00 0.00 H new ATOM 0 HB3 GLN A 25 1.296 11.674 -6.090 1.00 0.00 H new ATOM 0 HG2 GLN A 25 2.036 9.012 -7.405 1.00 0.00 H new ATOM 0 HG3 GLN A 25 0.895 10.144 -8.104 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.084 9.237 -8.329 1.00 0.00 H new ATOM 0 HE22 GLN A 25 4.791 10.780 -8.822 1.00 0.00 H new ATOM 394 N GLU A 26 1.455 10.483 -2.947 1.00 0.00 N ATOM 395 CA GLU A 26 1.181 11.108 -1.655 1.00 0.00 C ATOM 396 C GLU A 26 2.400 10.992 -0.736 1.00 0.00 C ATOM 397 O GLU A 26 2.688 11.897 0.047 1.00 0.00 O ATOM 398 CB GLU A 26 -0.039 10.434 -1.001 1.00 0.00 C ATOM 399 CG GLU A 26 -1.333 11.042 -1.555 1.00 0.00 C ATOM 400 CD GLU A 26 -1.331 10.969 -3.077 1.00 0.00 C ATOM 401 OE1 GLU A 26 -0.554 11.687 -3.685 1.00 0.00 O ATOM 402 OE2 GLU A 26 -2.107 10.197 -3.615 1.00 0.00 O ATOM 0 H GLU A 26 0.896 9.653 -3.144 1.00 0.00 H new ATOM 0 HA GLU A 26 0.966 12.165 -1.813 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.019 9.361 -1.194 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.000 10.564 0.081 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -2.196 10.507 -1.158 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.425 12.079 -1.232 1.00 0.00 H new ATOM 409 N HIS A 27 3.108 9.869 -0.842 1.00 0.00 N ATOM 410 CA HIS A 27 4.296 9.635 -0.021 1.00 0.00 C ATOM 411 C HIS A 27 5.530 10.259 -0.672 1.00 0.00 C ATOM 412 O HIS A 27 6.548 10.467 -0.012 1.00 0.00 O ATOM 413 CB HIS A 27 4.506 8.117 0.172 1.00 0.00 C ATOM 414 CG HIS A 27 3.816 7.657 1.430 1.00 0.00 C ATOM 415 ND1 HIS A 27 2.437 7.687 1.575 1.00 0.00 N ATOM 416 CD2 HIS A 27 4.306 7.158 2.612 1.00 0.00 C ATOM 417 CE1 HIS A 27 2.150 7.222 2.804 1.00 0.00 C ATOM 418 NE2 HIS A 27 3.253 6.885 3.478 1.00 0.00 N ATOM 0 H HIS A 27 2.882 9.110 -1.485 1.00 0.00 H new ATOM 0 HA HIS A 27 4.148 10.103 0.952 1.00 0.00 H new ATOM 0 HB2 HIS A 27 4.112 7.575 -0.688 1.00 0.00 H new ATOM 0 HB3 HIS A 27 5.571 7.893 0.229 1.00 0.00 H new ATOM 0 HD1 HIS A 27 1.764 8.004 0.877 1.00 0.00 H new ATOM 0 HD2 HIS A 27 5.351 7.001 2.835 1.00 0.00 H new ATOM 0 HE1 HIS A 27 1.149 7.132 3.198 1.00 0.00 H new ATOM 426 N ASP A 28 5.442 10.543 -1.963 1.00 0.00 N ATOM 427 CA ASP A 28 6.567 11.129 -2.677 1.00 0.00 C ATOM 428 C ASP A 28 6.941 12.476 -2.070 1.00 0.00 C ATOM 429 O ASP A 28 8.119 12.777 -1.880 1.00 0.00 O ATOM 430 CB ASP A 28 6.208 11.311 -4.149 1.00 0.00 C ATOM 431 CG ASP A 28 7.375 11.947 -4.894 1.00 0.00 C ATOM 432 OD1 ASP A 28 8.454 12.002 -4.326 1.00 0.00 O ATOM 433 OD2 ASP A 28 7.172 12.369 -6.019 1.00 0.00 O ATOM 0 H ASP A 28 4.612 10.379 -2.533 1.00 0.00 H new ATOM 0 HA ASP A 28 7.421 10.457 -2.592 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.964 10.347 -4.594 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.322 11.939 -4.241 1.00 0.00 H new ATOM 438 N LYS A 29 5.934 13.278 -1.761 1.00 0.00 N ATOM 439 CA LYS A 29 6.171 14.588 -1.172 1.00 0.00 C ATOM 440 C LYS A 29 6.724 14.447 0.246 1.00 0.00 C ATOM 441 O LYS A 29 7.431 15.328 0.735 1.00 0.00 O ATOM 442 CB LYS A 29 4.869 15.396 -1.145 1.00 0.00 C ATOM 443 CG LYS A 29 3.715 14.490 -0.682 1.00 0.00 C ATOM 444 CD LYS A 29 2.471 15.326 -0.336 1.00 0.00 C ATOM 445 CE LYS A 29 1.695 15.699 -1.607 1.00 0.00 C ATOM 446 NZ LYS A 29 0.720 14.616 -1.920 1.00 0.00 N ATOM 0 H LYS A 29 4.951 13.048 -1.907 1.00 0.00 H new ATOM 0 HA LYS A 29 6.906 15.113 -1.783 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.970 16.247 -0.472 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.656 15.797 -2.136 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.471 13.774 -1.467 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.026 13.914 0.190 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.825 14.763 0.338 1.00 0.00 H new ATOM 0 HD3 LYS A 29 2.771 16.231 0.192 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.173 16.645 -1.464 1.00 0.00 H new ATOM 0 HE3 LYS A 29 2.383 15.837 -2.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.168 15.036 -2.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.115 13.996 -2.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 0.532 14.059 -1.062 1.00 0.00 H new ATOM 460 N ARG A 30 6.388 13.340 0.904 1.00 0.00 N ATOM 461 CA ARG A 30 6.853 13.101 2.270 1.00 0.00 C ATOM 462 C ARG A 30 8.171 12.347 2.275 1.00 0.00 C ATOM 463 O ARG A 30 9.189 12.873 2.721 1.00 0.00 O ATOM 464 CB ARG A 30 5.803 12.290 3.032 1.00 0.00 C ATOM 465 CG ARG A 30 4.630 13.204 3.406 1.00 0.00 C ATOM 466 CD ARG A 30 5.020 14.157 4.556 1.00 0.00 C ATOM 467 NE ARG A 30 4.919 15.543 4.115 1.00 0.00 N ATOM 468 CZ ARG A 30 5.225 16.542 4.933 1.00 0.00 C ATOM 469 NH1 ARG A 30 5.613 16.285 6.152 1.00 0.00 N ATOM 470 NH2 ARG A 30 5.141 17.777 4.519 1.00 0.00 N ATOM 0 H ARG A 30 5.801 12.600 0.519 1.00 0.00 H new ATOM 0 HA ARG A 30 7.005 14.066 2.754 1.00 0.00 H new ATOM 0 HB2 ARG A 30 5.451 11.461 2.418 1.00 0.00 H new ATOM 0 HB3 ARG A 30 6.243 11.857 3.931 1.00 0.00 H new ATOM 0 HG2 ARG A 30 4.324 13.784 2.535 1.00 0.00 H new ATOM 0 HG3 ARG A 30 3.773 12.600 3.704 1.00 0.00 H new ATOM 0 HD2 ARG A 30 4.367 13.992 5.413 1.00 0.00 H new ATOM 0 HD3 ARG A 30 6.037 13.945 4.885 1.00 0.00 H new ATOM 0 HE ARG A 30 4.609 15.747 3.165 1.00 0.00 H new ATOM 0 HH11 ARG A 30 5.680 15.319 6.473 1.00 0.00 H new ATOM 0 HH12 ARG A 30 5.849 17.050 6.784 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.840 17.976 3.565 1.00 0.00 H new ATOM 0 HH22 ARG A 30 5.377 18.543 5.149 1.00 0.00 H new ATOM 484 N ASP A 31 8.145 11.105 1.786 1.00 0.00 N ATOM 485 CA ASP A 31 9.351 10.274 1.753 1.00 0.00 C ATOM 486 C ASP A 31 9.631 9.759 0.331 1.00 0.00 C ATOM 487 O ASP A 31 8.834 8.991 -0.221 1.00 0.00 O ATOM 488 CB ASP A 31 9.190 9.089 2.709 1.00 0.00 C ATOM 489 CG ASP A 31 9.304 9.581 4.148 1.00 0.00 C ATOM 490 OD1 ASP A 31 9.342 10.786 4.337 1.00 0.00 O ATOM 491 OD2 ASP A 31 9.358 8.748 5.039 1.00 0.00 O ATOM 0 H ASP A 31 7.310 10.655 1.410 1.00 0.00 H new ATOM 0 HA ASP A 31 10.196 10.887 2.067 1.00 0.00 H new ATOM 0 HB2 ASP A 31 8.224 8.610 2.552 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.954 8.339 2.508 1.00 0.00 H new ATOM 496 N PRO A 32 10.731 10.162 -0.285 1.00 0.00 N ATOM 497 CA PRO A 32 11.069 9.717 -1.669 1.00 0.00 C ATOM 498 C PRO A 32 11.511 8.257 -1.708 1.00 0.00 C ATOM 499 O PRO A 32 11.320 7.567 -2.708 1.00 0.00 O ATOM 500 CB PRO A 32 12.205 10.662 -2.093 1.00 0.00 C ATOM 501 CG PRO A 32 12.864 11.082 -0.820 1.00 0.00 C ATOM 502 CD PRO A 32 11.776 11.059 0.263 1.00 0.00 C ATOM 0 HA PRO A 32 10.210 9.764 -2.339 1.00 0.00 H new ATOM 0 HB2 PRO A 32 12.910 10.158 -2.753 1.00 0.00 H new ATOM 0 HB3 PRO A 32 11.818 11.523 -2.638 1.00 0.00 H new ATOM 0 HG2 PRO A 32 13.680 10.406 -0.564 1.00 0.00 H new ATOM 0 HG3 PRO A 32 13.294 12.079 -0.916 1.00 0.00 H new ATOM 0 HD2 PRO A 32 12.165 10.684 1.210 1.00 0.00 H new ATOM 0 HD3 PRO A 32 11.383 12.058 0.453 1.00 0.00 H new ATOM 510 N VAL A 33 12.108 7.794 -0.617 1.00 0.00 N ATOM 511 CA VAL A 33 12.583 6.418 -0.546 1.00 0.00 C ATOM 512 C VAL A 33 11.410 5.454 -0.679 1.00 0.00 C ATOM 513 O VAL A 33 11.467 4.491 -1.447 1.00 0.00 O ATOM 514 CB VAL A 33 13.298 6.182 0.792 1.00 0.00 C ATOM 515 CG1 VAL A 33 13.859 4.754 0.865 1.00 0.00 C ATOM 516 CG2 VAL A 33 14.443 7.186 0.944 1.00 0.00 C ATOM 0 H VAL A 33 12.274 8.346 0.225 1.00 0.00 H new ATOM 0 HA VAL A 33 13.283 6.243 -1.363 1.00 0.00 H new ATOM 0 HB VAL A 33 12.577 6.316 1.599 1.00 0.00 H new ATOM 0 HG11 VAL A 33 14.361 4.609 1.821 1.00 0.00 H new ATOM 0 HG12 VAL A 33 13.043 4.037 0.771 1.00 0.00 H new ATOM 0 HG13 VAL A 33 14.571 4.601 0.054 1.00 0.00 H new ATOM 0 HG21 VAL A 33 14.950 7.018 1.894 1.00 0.00 H new ATOM 0 HG22 VAL A 33 15.152 7.056 0.126 1.00 0.00 H new ATOM 0 HG23 VAL A 33 14.043 8.200 0.920 1.00 0.00 H new ATOM 526 N VAL A 34 10.340 5.733 0.057 1.00 0.00 N ATOM 527 CA VAL A 34 9.155 4.892 0.002 1.00 0.00 C ATOM 528 C VAL A 34 8.528 4.954 -1.385 1.00 0.00 C ATOM 529 O VAL A 34 8.187 3.925 -1.967 1.00 0.00 O ATOM 530 CB VAL A 34 8.136 5.350 1.053 1.00 0.00 C ATOM 531 CG1 VAL A 34 6.846 4.540 0.906 1.00 0.00 C ATOM 532 CG2 VAL A 34 8.718 5.136 2.453 1.00 0.00 C ATOM 0 H VAL A 34 10.270 6.528 0.692 1.00 0.00 H new ATOM 0 HA VAL A 34 9.448 3.863 0.212 1.00 0.00 H new ATOM 0 HB VAL A 34 7.916 6.408 0.908 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.124 4.867 1.654 1.00 0.00 H new ATOM 0 HG12 VAL A 34 6.432 4.693 -0.090 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.063 3.481 1.050 1.00 0.00 H new ATOM 0 HG21 VAL A 34 7.995 5.461 3.201 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.939 4.078 2.597 1.00 0.00 H new ATOM 0 HG23 VAL A 34 9.635 5.716 2.558 1.00 0.00 H new ATOM 542 N ALA A 35 8.377 6.167 -1.908 1.00 0.00 N ATOM 543 CA ALA A 35 7.783 6.337 -3.229 1.00 0.00 C ATOM 544 C ALA A 35 8.631 5.656 -4.296 1.00 0.00 C ATOM 545 O ALA A 35 8.101 5.056 -5.231 1.00 0.00 O ATOM 546 CB ALA A 35 7.648 7.825 -3.555 1.00 0.00 C ATOM 0 H ALA A 35 8.653 7.034 -1.446 1.00 0.00 H new ATOM 0 HA ALA A 35 6.796 5.875 -3.220 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.204 7.942 -4.543 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.011 8.304 -2.812 1.00 0.00 H new ATOM 0 HB3 ALA A 35 8.633 8.291 -3.543 1.00 0.00 H new ATOM 552 N TYR A 36 9.948 5.747 -4.153 1.00 0.00 N ATOM 553 CA TYR A 36 10.853 5.137 -5.116 1.00 0.00 C ATOM 554 C TYR A 36 10.562 3.645 -5.239 1.00 0.00 C ATOM 555 O TYR A 36 10.409 3.119 -6.343 1.00 0.00 O ATOM 556 CB TYR A 36 12.298 5.341 -4.660 1.00 0.00 C ATOM 557 CG TYR A 36 13.232 4.628 -5.607 1.00 0.00 C ATOM 558 CD1 TYR A 36 13.706 5.279 -6.751 1.00 0.00 C ATOM 559 CD2 TYR A 36 13.619 3.310 -5.340 1.00 0.00 C ATOM 560 CE1 TYR A 36 14.570 4.612 -7.628 1.00 0.00 C ATOM 561 CE2 TYR A 36 14.481 2.643 -6.216 1.00 0.00 C ATOM 562 CZ TYR A 36 14.958 3.293 -7.360 1.00 0.00 C ATOM 563 OH TYR A 36 15.808 2.635 -8.224 1.00 0.00 O ATOM 0 H TYR A 36 10.409 6.234 -3.385 1.00 0.00 H new ATOM 0 HA TYR A 36 10.706 5.608 -6.088 1.00 0.00 H new ATOM 0 HB2 TYR A 36 12.535 6.405 -4.632 1.00 0.00 H new ATOM 0 HB3 TYR A 36 12.428 4.958 -3.648 1.00 0.00 H new ATOM 0 HD1 TYR A 36 13.406 6.296 -6.958 1.00 0.00 H new ATOM 0 HD2 TYR A 36 13.252 2.808 -4.457 1.00 0.00 H new ATOM 0 HE1 TYR A 36 14.937 5.114 -8.511 1.00 0.00 H new ATOM 0 HE2 TYR A 36 14.779 1.626 -6.010 1.00 0.00 H new ATOM 0 HH TYR A 36 15.977 1.729 -7.890 1.00 0.00 H new ATOM 573 N TYR A 37 10.472 2.969 -4.098 1.00 0.00 N ATOM 574 CA TYR A 37 10.182 1.541 -4.101 1.00 0.00 C ATOM 575 C TYR A 37 8.789 1.284 -4.668 1.00 0.00 C ATOM 576 O TYR A 37 8.577 0.313 -5.394 1.00 0.00 O ATOM 577 CB TYR A 37 10.295 0.964 -2.675 1.00 0.00 C ATOM 578 CG TYR A 37 11.700 0.466 -2.427 1.00 0.00 C ATOM 579 CD1 TYR A 37 12.114 -0.732 -3.013 1.00 0.00 C ATOM 580 CD2 TYR A 37 12.582 1.194 -1.618 1.00 0.00 C ATOM 581 CE1 TYR A 37 13.408 -1.210 -2.795 1.00 0.00 C ATOM 582 CE2 TYR A 37 13.881 0.715 -1.397 1.00 0.00 C ATOM 583 CZ TYR A 37 14.294 -0.486 -1.987 1.00 0.00 C ATOM 584 OH TYR A 37 15.571 -0.961 -1.770 1.00 0.00 O ATOM 0 H TYR A 37 10.594 3.380 -3.173 1.00 0.00 H new ATOM 0 HA TYR A 37 10.914 1.041 -4.735 1.00 0.00 H new ATOM 0 HB2 TYR A 37 10.038 1.729 -1.943 1.00 0.00 H new ATOM 0 HB3 TYR A 37 9.584 0.148 -2.547 1.00 0.00 H new ATOM 0 HD1 TYR A 37 11.432 -1.290 -3.637 1.00 0.00 H new ATOM 0 HD2 TYR A 37 12.262 2.121 -1.166 1.00 0.00 H new ATOM 0 HE1 TYR A 37 13.725 -2.137 -3.249 1.00 0.00 H new ATOM 0 HE2 TYR A 37 14.563 1.272 -0.772 1.00 0.00 H new ATOM 0 HH TYR A 37 16.220 -0.248 -1.946 1.00 0.00 H new ATOM 594 N CYS A 38 7.839 2.145 -4.332 1.00 0.00 N ATOM 595 CA CYS A 38 6.479 1.979 -4.816 1.00 0.00 C ATOM 596 C CYS A 38 6.442 1.970 -6.341 1.00 0.00 C ATOM 597 O CYS A 38 5.801 1.113 -6.950 1.00 0.00 O ATOM 598 CB CYS A 38 5.608 3.118 -4.300 1.00 0.00 C ATOM 599 SG CYS A 38 5.660 3.141 -2.493 1.00 0.00 S ATOM 0 H CYS A 38 7.984 2.957 -3.732 1.00 0.00 H new ATOM 0 HA CYS A 38 6.100 1.025 -4.450 1.00 0.00 H new ATOM 0 HB2 CYS A 38 5.961 4.070 -4.697 1.00 0.00 H new ATOM 0 HB3 CYS A 38 4.582 2.990 -4.644 1.00 0.00 H new ATOM 0 HG CYS A 38 6.874 3.382 -2.097 1.00 0.00 H new ATOM 605 N ARG A 39 7.121 2.928 -6.957 1.00 0.00 N ATOM 606 CA ARG A 39 7.138 3.009 -8.410 1.00 0.00 C ATOM 607 C ARG A 39 7.724 1.729 -8.987 1.00 0.00 C ATOM 608 O ARG A 39 7.210 1.178 -9.961 1.00 0.00 O ATOM 609 CB ARG A 39 7.990 4.203 -8.851 1.00 0.00 C ATOM 610 CG ARG A 39 7.313 5.506 -8.413 1.00 0.00 C ATOM 611 CD ARG A 39 8.161 6.710 -8.847 1.00 0.00 C ATOM 612 NE ARG A 39 7.917 7.845 -7.960 1.00 0.00 N ATOM 613 CZ ARG A 39 8.801 8.834 -7.854 1.00 0.00 C ATOM 614 NH1 ARG A 39 9.896 8.801 -8.559 1.00 0.00 N ATOM 615 NH2 ARG A 39 8.574 9.830 -7.042 1.00 0.00 N ATOM 0 H ARG A 39 7.660 3.651 -6.481 1.00 0.00 H new ATOM 0 HA ARG A 39 6.118 3.138 -8.773 1.00 0.00 H new ATOM 0 HB2 ARG A 39 8.986 4.134 -8.413 1.00 0.00 H new ATOM 0 HB3 ARG A 39 8.116 4.193 -9.934 1.00 0.00 H new ATOM 0 HG2 ARG A 39 6.318 5.574 -8.853 1.00 0.00 H new ATOM 0 HG3 ARG A 39 7.184 5.513 -7.331 1.00 0.00 H new ATOM 0 HD2 ARG A 39 9.218 6.445 -8.828 1.00 0.00 H new ATOM 0 HD3 ARG A 39 7.919 6.983 -9.874 1.00 0.00 H new ATOM 0 HE ARG A 39 7.056 7.880 -7.414 1.00 0.00 H new ATOM 0 HH11 ARG A 39 10.073 8.019 -9.189 1.00 0.00 H new ATOM 0 HH12 ARG A 39 10.576 9.557 -8.481 1.00 0.00 H new ATOM 0 HH21 ARG A 39 7.718 9.851 -6.488 1.00 0.00 H new ATOM 0 HH22 ARG A 39 9.252 10.587 -6.962 1.00 0.00 H new ATOM 629 N LEU A 40 8.818 1.270 -8.390 1.00 0.00 N ATOM 630 CA LEU A 40 9.476 0.058 -8.869 1.00 0.00 C ATOM 631 C LEU A 40 8.511 -1.125 -8.773 1.00 0.00 C ATOM 632 O LEU A 40 8.354 -1.887 -9.726 1.00 0.00 O ATOM 633 CB LEU A 40 10.747 -0.215 -8.041 1.00 0.00 C ATOM 634 CG LEU A 40 11.759 -1.062 -8.842 1.00 0.00 C ATOM 635 CD1 LEU A 40 13.125 -1.001 -8.148 1.00 0.00 C ATOM 636 CD2 LEU A 40 11.305 -2.529 -8.929 1.00 0.00 C ATOM 0 H LEU A 40 9.264 1.710 -7.585 1.00 0.00 H new ATOM 0 HA LEU A 40 9.765 0.193 -9.911 1.00 0.00 H new ATOM 0 HB2 LEU A 40 11.207 0.730 -7.752 1.00 0.00 H new ATOM 0 HB3 LEU A 40 10.481 -0.735 -7.121 1.00 0.00 H new ATOM 0 HG LEU A 40 11.825 -0.659 -9.852 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.845 -1.597 -8.709 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.466 0.034 -8.105 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.037 -1.396 -7.136 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.036 -3.103 -9.498 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.221 -2.944 -7.925 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.336 -2.581 -9.426 1.00 0.00 H new ATOM 648 N TYR A 41 7.838 -1.249 -7.632 1.00 0.00 N ATOM 649 CA TYR A 41 6.872 -2.325 -7.436 1.00 0.00 C ATOM 650 C TYR A 41 5.856 -2.336 -8.580 1.00 0.00 C ATOM 651 O TYR A 41 5.495 -3.395 -9.098 1.00 0.00 O ATOM 652 CB TYR A 41 6.154 -2.133 -6.086 1.00 0.00 C ATOM 653 CG TYR A 41 4.830 -2.868 -6.090 1.00 0.00 C ATOM 654 CD1 TYR A 41 3.701 -2.245 -6.632 1.00 0.00 C ATOM 655 CD2 TYR A 41 4.737 -4.169 -5.586 1.00 0.00 C ATOM 656 CE1 TYR A 41 2.478 -2.919 -6.665 1.00 0.00 C ATOM 657 CE2 TYR A 41 3.513 -4.848 -5.624 1.00 0.00 C ATOM 658 CZ TYR A 41 2.384 -4.224 -6.165 1.00 0.00 C ATOM 659 OH TYR A 41 1.180 -4.894 -6.211 1.00 0.00 O ATOM 0 H TYR A 41 7.943 -0.622 -6.834 1.00 0.00 H new ATOM 0 HA TYR A 41 7.395 -3.281 -7.429 1.00 0.00 H new ATOM 0 HB2 TYR A 41 6.782 -2.504 -5.276 1.00 0.00 H new ATOM 0 HB3 TYR A 41 5.989 -1.072 -5.901 1.00 0.00 H new ATOM 0 HD1 TYR A 41 3.775 -1.242 -7.025 1.00 0.00 H new ATOM 0 HD2 TYR A 41 5.609 -4.650 -5.168 1.00 0.00 H new ATOM 0 HE1 TYR A 41 1.605 -2.434 -7.076 1.00 0.00 H new ATOM 0 HE2 TYR A 41 3.441 -5.853 -5.236 1.00 0.00 H new ATOM 0 HH TYR A 41 1.288 -5.788 -5.825 1.00 0.00 H new ATOM 669 N ALA A 42 5.386 -1.162 -8.953 1.00 0.00 N ATOM 670 CA ALA A 42 4.409 -1.065 -10.025 1.00 0.00 C ATOM 671 C ALA A 42 4.988 -1.600 -11.330 1.00 0.00 C ATOM 672 O ALA A 42 4.351 -2.390 -12.020 1.00 0.00 O ATOM 673 CB ALA A 42 3.965 0.386 -10.205 1.00 0.00 C ATOM 0 H ALA A 42 5.659 -0.271 -8.537 1.00 0.00 H new ATOM 0 HA ALA A 42 3.543 -1.670 -9.756 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.233 0.445 -11.011 1.00 0.00 H new ATOM 0 HB2 ALA A 42 3.516 0.746 -9.280 1.00 0.00 H new ATOM 0 HB3 ALA A 42 4.829 1.003 -10.453 1.00 0.00 H new ATOM 679 N MET A 43 6.189 -1.146 -11.675 1.00 0.00 N ATOM 680 CA MET A 43 6.830 -1.571 -12.912 1.00 0.00 C ATOM 681 C MET A 43 6.816 -3.096 -13.037 1.00 0.00 C ATOM 682 O MET A 43 6.205 -3.649 -13.953 1.00 0.00 O ATOM 683 CB MET A 43 8.278 -1.056 -12.930 1.00 0.00 C ATOM 684 CG MET A 43 8.708 -0.778 -14.370 1.00 0.00 C ATOM 685 SD MET A 43 10.513 -0.710 -14.463 1.00 0.00 S ATOM 686 CE MET A 43 10.786 -2.478 -14.743 1.00 0.00 C ATOM 0 H MET A 43 6.734 -0.488 -11.118 1.00 0.00 H new ATOM 0 HA MET A 43 6.279 -1.158 -13.757 1.00 0.00 H new ATOM 0 HB2 MET A 43 8.358 -0.147 -12.334 1.00 0.00 H new ATOM 0 HB3 MET A 43 8.942 -1.793 -12.478 1.00 0.00 H new ATOM 0 HG2 MET A 43 8.329 -1.558 -15.030 1.00 0.00 H new ATOM 0 HG3 MET A 43 8.281 0.165 -14.712 1.00 0.00 H new ATOM 0 HE1 MET A 43 11.855 -2.671 -14.833 1.00 0.00 H new ATOM 0 HE2 MET A 43 10.384 -3.046 -13.904 1.00 0.00 H new ATOM 0 HE3 MET A 43 10.284 -2.783 -15.661 1.00 0.00 H new ATOM 696 N GLN A 44 7.499 -3.761 -12.113 1.00 0.00 N ATOM 697 CA GLN A 44 7.573 -5.223 -12.118 1.00 0.00 C ATOM 698 C GLN A 44 6.175 -5.831 -12.145 1.00 0.00 C ATOM 699 O GLN A 44 5.945 -6.873 -12.760 1.00 0.00 O ATOM 700 CB GLN A 44 8.328 -5.717 -10.879 1.00 0.00 C ATOM 701 CG GLN A 44 7.639 -5.202 -9.613 1.00 0.00 C ATOM 702 CD GLN A 44 8.396 -5.668 -8.377 1.00 0.00 C ATOM 703 OE1 GLN A 44 9.274 -4.874 -7.832 1.00 0.00 O flip ATOM 704 NE2 GLN A 44 8.185 -6.782 -7.897 1.00 0.00 N flip ATOM 0 H GLN A 44 8.010 -3.315 -11.351 1.00 0.00 H new ATOM 0 HA GLN A 44 8.109 -5.536 -13.014 1.00 0.00 H new ATOM 0 HB2 GLN A 44 8.358 -6.807 -10.870 1.00 0.00 H new ATOM 0 HB3 GLN A 44 9.361 -5.370 -10.909 1.00 0.00 H new ATOM 0 HG2 GLN A 44 7.594 -4.113 -9.632 1.00 0.00 H new ATOM 0 HG3 GLN A 44 6.611 -5.563 -9.577 1.00 0.00 H new ATOM 0 HE21 GLN A 44 7.497 -7.400 -8.327 1.00 0.00 H new ATOM 0 HE22 GLN A 44 8.698 -7.086 -7.070 1.00 0.00 H new ATOM 713 N THR A 45 5.242 -5.182 -11.471 1.00 0.00 N ATOM 714 CA THR A 45 3.877 -5.673 -11.432 1.00 0.00 C ATOM 715 C THR A 45 3.199 -5.463 -12.784 1.00 0.00 C ATOM 716 O THR A 45 2.440 -6.311 -13.250 1.00 0.00 O ATOM 717 CB THR A 45 3.091 -4.953 -10.332 1.00 0.00 C ATOM 718 OG1 THR A 45 3.711 -5.206 -9.080 1.00 0.00 O ATOM 719 CG2 THR A 45 1.647 -5.470 -10.289 1.00 0.00 C ATOM 0 H THR A 45 5.403 -4.321 -10.948 1.00 0.00 H new ATOM 0 HA THR A 45 3.896 -6.741 -11.213 1.00 0.00 H new ATOM 0 HB THR A 45 3.082 -3.883 -10.540 1.00 0.00 H new ATOM 0 HG1 THR A 45 4.442 -4.568 -8.942 1.00 0.00 H new ATOM 0 HG21 THR A 45 1.098 -4.951 -9.503 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.166 -5.286 -11.250 1.00 0.00 H new ATOM 0 HG23 THR A 45 1.650 -6.540 -10.083 1.00 0.00 H new ATOM 727 N GLY A 46 3.466 -4.313 -13.397 1.00 0.00 N ATOM 728 CA GLY A 46 2.863 -3.982 -14.685 1.00 0.00 C ATOM 729 C GLY A 46 3.284 -4.961 -15.778 1.00 0.00 C ATOM 730 O GLY A 46 2.433 -5.520 -16.464 1.00 0.00 O ATOM 0 H GLY A 46 4.092 -3.598 -13.026 1.00 0.00 H new ATOM 0 HA2 GLY A 46 1.777 -3.989 -14.590 1.00 0.00 H new ATOM 0 HA3 GLY A 46 3.152 -2.971 -14.972 1.00 0.00 H new ATOM 734 N MET A 47 4.590 -5.174 -15.926 1.00 0.00 N ATOM 735 CA MET A 47 5.090 -6.097 -16.944 1.00 0.00 C ATOM 736 C MET A 47 4.561 -7.503 -16.678 1.00 0.00 C ATOM 737 O MET A 47 4.229 -8.240 -17.608 1.00 0.00 O ATOM 738 CB MET A 47 6.625 -6.116 -16.945 1.00 0.00 C ATOM 739 CG MET A 47 7.137 -6.596 -15.586 1.00 0.00 C ATOM 740 SD MET A 47 7.157 -8.407 -15.552 1.00 0.00 S ATOM 741 CE MET A 47 8.924 -8.634 -15.233 1.00 0.00 C ATOM 0 H MET A 47 5.313 -4.727 -15.362 1.00 0.00 H new ATOM 0 HA MET A 47 4.741 -5.758 -17.919 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.989 -6.774 -17.734 1.00 0.00 H new ATOM 0 HB3 MET A 47 7.010 -5.119 -17.158 1.00 0.00 H new ATOM 0 HG2 MET A 47 8.139 -6.207 -15.405 1.00 0.00 H new ATOM 0 HG3 MET A 47 6.499 -6.214 -14.789 1.00 0.00 H new ATOM 0 HE1 MET A 47 9.149 -9.699 -15.175 1.00 0.00 H new ATOM 0 HE2 MET A 47 9.500 -8.185 -16.042 1.00 0.00 H new ATOM 0 HE3 MET A 47 9.188 -8.155 -14.290 1.00 0.00 H new ATOM 751 N LYS A 48 4.483 -7.870 -15.402 1.00 0.00 N ATOM 752 CA LYS A 48 3.986 -9.191 -15.040 1.00 0.00 C ATOM 753 C LYS A 48 2.542 -9.365 -15.505 1.00 0.00 C ATOM 754 O LYS A 48 2.172 -10.417 -16.026 1.00 0.00 O ATOM 755 CB LYS A 48 4.057 -9.385 -13.526 1.00 0.00 C ATOM 756 CG LYS A 48 3.926 -10.876 -13.192 1.00 0.00 C ATOM 757 CD LYS A 48 3.598 -11.038 -11.705 1.00 0.00 C ATOM 758 CE LYS A 48 3.695 -12.514 -11.294 1.00 0.00 C ATOM 759 NZ LYS A 48 5.103 -12.819 -10.920 1.00 0.00 N ATOM 0 H LYS A 48 4.753 -7.281 -14.614 1.00 0.00 H new ATOM 0 HA LYS A 48 4.611 -9.937 -15.531 1.00 0.00 H new ATOM 0 HB2 LYS A 48 5.001 -8.998 -13.143 1.00 0.00 H new ATOM 0 HB3 LYS A 48 3.261 -8.822 -13.039 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.142 -11.328 -13.800 1.00 0.00 H new ATOM 0 HG3 LYS A 48 4.854 -11.396 -13.430 1.00 0.00 H new ATOM 0 HD2 LYS A 48 4.287 -10.441 -11.107 1.00 0.00 H new ATOM 0 HD3 LYS A 48 2.594 -10.663 -11.504 1.00 0.00 H new ATOM 0 HE2 LYS A 48 3.030 -12.716 -10.454 1.00 0.00 H new ATOM 0 HE3 LYS A 48 3.376 -13.156 -12.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 5.179 -13.818 -10.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 5.725 -12.639 -11.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 5.390 -12.213 -10.125 1.00 0.00 H new ATOM 773 N ILE A 49 1.727 -8.333 -15.299 1.00 0.00 N ATOM 774 CA ILE A 49 0.320 -8.382 -15.692 1.00 0.00 C ATOM 775 C ILE A 49 0.154 -8.216 -17.202 1.00 0.00 C ATOM 776 O ILE A 49 -0.497 -9.033 -17.852 1.00 0.00 O ATOM 777 CB ILE A 49 -0.456 -7.281 -14.959 1.00 0.00 C ATOM 778 CG1 ILE A 49 -0.609 -7.663 -13.484 1.00 0.00 C ATOM 779 CG2 ILE A 49 -1.839 -7.094 -15.596 1.00 0.00 C ATOM 780 CD1 ILE A 49 -1.090 -6.447 -12.697 1.00 0.00 C ATOM 0 H ILE A 49 2.014 -7.456 -14.864 1.00 0.00 H new ATOM 0 HA ILE A 49 -0.076 -9.360 -15.418 1.00 0.00 H new ATOM 0 HB ILE A 49 0.094 -6.343 -15.037 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -1.320 -8.483 -13.380 1.00 0.00 H new ATOM 0 HG13 ILE A 49 0.343 -8.015 -13.087 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -2.380 -6.310 -15.067 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -1.722 -6.812 -16.642 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -2.398 -8.027 -15.532 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.200 -6.714 -11.646 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -0.362 -5.641 -12.792 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.051 -6.116 -13.090 1.00 0.00 H new ATOM 792 N ASP A 50 0.722 -7.140 -17.745 1.00 0.00 N ATOM 793 CA ASP A 50 0.606 -6.859 -19.167 1.00 0.00 C ATOM 794 C ASP A 50 0.926 -8.099 -19.982 1.00 0.00 C ATOM 795 O ASP A 50 1.192 -9.170 -19.440 1.00 0.00 O ATOM 796 CB ASP A 50 1.535 -5.680 -19.547 1.00 0.00 C ATOM 797 CG ASP A 50 2.799 -6.158 -20.272 1.00 0.00 C ATOM 798 OD1 ASP A 50 3.445 -7.061 -19.765 1.00 0.00 O ATOM 799 OD2 ASP A 50 3.099 -5.610 -21.320 1.00 0.00 O ATOM 0 H ASP A 50 1.264 -6.454 -17.220 1.00 0.00 H new ATOM 0 HA ASP A 50 -0.421 -6.572 -19.393 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.993 -4.982 -20.185 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.817 -5.135 -18.646 1.00 0.00 H new ATOM 804 N SER A 51 0.915 -7.936 -21.292 1.00 0.00 N ATOM 805 CA SER A 51 1.220 -9.038 -22.186 1.00 0.00 C ATOM 806 C SER A 51 1.564 -8.523 -23.578 1.00 0.00 C ATOM 807 O SER A 51 0.916 -8.880 -24.557 1.00 0.00 O ATOM 808 CB SER A 51 0.032 -9.994 -22.266 1.00 0.00 C ATOM 809 OG SER A 51 0.000 -10.792 -21.090 1.00 0.00 O ATOM 0 H SER A 51 0.699 -7.055 -21.759 1.00 0.00 H new ATOM 0 HA SER A 51 2.084 -9.572 -21.789 1.00 0.00 H new ATOM 0 HB2 SER A 51 -0.897 -9.433 -22.365 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.117 -10.628 -23.149 1.00 0.00 H new ATOM 0 HG SER A 51 0.721 -10.514 -20.487 1.00 0.00 H new ATOM 815 N LYS A 52 2.588 -7.680 -23.642 1.00 0.00 N ATOM 816 CA LYS A 52 3.034 -7.109 -24.912 1.00 0.00 C ATOM 817 C LYS A 52 1.940 -6.246 -25.516 1.00 0.00 C ATOM 818 O LYS A 52 0.989 -6.756 -26.107 1.00 0.00 O ATOM 819 CB LYS A 52 3.399 -8.221 -25.905 1.00 0.00 C ATOM 820 CG LYS A 52 4.408 -9.166 -25.258 1.00 0.00 C ATOM 821 CD LYS A 52 4.794 -10.264 -26.250 1.00 0.00 C ATOM 822 CE LYS A 52 5.704 -11.278 -25.556 1.00 0.00 C ATOM 823 NZ LYS A 52 6.011 -12.393 -26.495 1.00 0.00 N ATOM 0 H LYS A 52 3.126 -7.375 -22.831 1.00 0.00 H new ATOM 0 HA LYS A 52 3.915 -6.498 -24.715 1.00 0.00 H new ATOM 0 HB2 LYS A 52 2.504 -8.771 -26.197 1.00 0.00 H new ATOM 0 HB3 LYS A 52 3.819 -7.789 -26.814 1.00 0.00 H new ATOM 0 HG2 LYS A 52 5.295 -8.612 -24.951 1.00 0.00 H new ATOM 0 HG3 LYS A 52 3.981 -9.609 -24.358 1.00 0.00 H new ATOM 0 HD2 LYS A 52 3.899 -10.760 -26.627 1.00 0.00 H new ATOM 0 HD3 LYS A 52 5.304 -9.830 -27.110 1.00 0.00 H new ATOM 0 HE2 LYS A 52 6.626 -10.795 -25.234 1.00 0.00 H new ATOM 0 HE3 LYS A 52 5.218 -11.666 -24.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 6.630 -13.083 -26.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 5.127 -12.860 -26.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 6.491 -12.016 -27.337 1.00 0.00 H new ATOM 837 N THR A 53 2.072 -4.934 -25.366 1.00 0.00 N ATOM 838 CA THR A 53 1.071 -4.022 -25.909 1.00 0.00 C ATOM 839 C THR A 53 1.604 -2.584 -25.932 1.00 0.00 C ATOM 840 O THR A 53 2.382 -2.201 -25.057 1.00 0.00 O ATOM 841 CB THR A 53 -0.208 -4.091 -25.060 1.00 0.00 C ATOM 842 OG1 THR A 53 -1.127 -3.104 -25.491 1.00 0.00 O ATOM 843 CG2 THR A 53 0.115 -3.844 -23.592 1.00 0.00 C ATOM 0 H THR A 53 2.848 -4.482 -24.882 1.00 0.00 H new ATOM 0 HA THR A 53 0.845 -4.323 -26.932 1.00 0.00 H new ATOM 0 HB THR A 53 -0.642 -5.084 -25.177 1.00 0.00 H new ATOM 0 HG1 THR A 53 -1.941 -3.155 -24.947 1.00 0.00 H new ATOM 0 HG21 THR A 53 -0.801 -3.896 -23.004 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.815 -4.602 -23.241 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.563 -2.857 -23.479 1.00 0.00 H new ATOM 851 N PRO A 54 1.217 -1.784 -26.909 1.00 0.00 N ATOM 852 CA PRO A 54 1.688 -0.364 -27.016 1.00 0.00 C ATOM 853 C PRO A 54 1.317 0.478 -25.795 1.00 0.00 C ATOM 854 O PRO A 54 2.104 1.305 -25.338 1.00 0.00 O ATOM 855 CB PRO A 54 1.001 0.159 -28.295 1.00 0.00 C ATOM 856 CG PRO A 54 -0.151 -0.763 -28.527 1.00 0.00 C ATOM 857 CD PRO A 54 0.301 -2.127 -28.016 1.00 0.00 C ATOM 0 HA PRO A 54 2.775 -0.302 -27.061 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.663 1.187 -28.168 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.688 0.152 -29.142 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -1.039 -0.421 -27.996 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -0.410 -0.808 -29.585 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -0.541 -2.727 -27.671 1.00 0.00 H new ATOM 0 HD3 PRO A 54 0.805 -2.702 -28.793 1.00 0.00 H new ATOM 865 N GLU A 55 0.115 0.270 -25.278 1.00 0.00 N ATOM 866 CA GLU A 55 -0.344 1.027 -24.122 1.00 0.00 C ATOM 867 C GLU A 55 0.589 0.822 -22.933 1.00 0.00 C ATOM 868 O GLU A 55 1.153 1.776 -22.399 1.00 0.00 O ATOM 869 CB GLU A 55 -1.759 0.569 -23.760 1.00 0.00 C ATOM 870 CG GLU A 55 -2.773 1.235 -24.692 1.00 0.00 C ATOM 871 CD GLU A 55 -2.441 0.920 -26.147 1.00 0.00 C ATOM 872 OE1 GLU A 55 -1.606 1.614 -26.708 1.00 0.00 O ATOM 873 OE2 GLU A 55 -3.030 -0.004 -26.683 1.00 0.00 O ATOM 0 H GLU A 55 -0.555 -0.410 -25.636 1.00 0.00 H new ATOM 0 HA GLU A 55 -0.347 2.089 -24.369 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.833 -0.515 -23.843 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.980 0.825 -22.724 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -3.778 0.884 -24.457 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -2.767 2.314 -24.536 1.00 0.00 H new ATOM 880 N CYS A 56 0.743 -0.426 -22.525 1.00 0.00 N ATOM 881 CA CYS A 56 1.603 -0.746 -21.397 1.00 0.00 C ATOM 882 C CYS A 56 3.053 -0.394 -21.708 1.00 0.00 C ATOM 883 O CYS A 56 3.769 0.113 -20.852 1.00 0.00 O ATOM 884 CB CYS A 56 1.503 -2.236 -21.066 1.00 0.00 C ATOM 885 SG CYS A 56 -0.232 -2.680 -20.795 1.00 0.00 S ATOM 0 H CYS A 56 0.287 -1.231 -22.955 1.00 0.00 H new ATOM 0 HA CYS A 56 1.272 -0.159 -20.540 1.00 0.00 H new ATOM 0 HB2 CYS A 56 1.918 -2.829 -21.881 1.00 0.00 H new ATOM 0 HB3 CYS A 56 2.090 -2.462 -20.176 1.00 0.00 H new ATOM 0 HG CYS A 56 -0.521 -2.551 -19.534 1.00 0.00 H new ATOM 891 N ARG A 57 3.481 -0.658 -22.936 1.00 0.00 N ATOM 892 CA ARG A 57 4.841 -0.363 -23.327 1.00 0.00 C ATOM 893 C ARG A 57 5.156 1.113 -23.110 1.00 0.00 C ATOM 894 O ARG A 57 6.199 1.460 -22.554 1.00 0.00 O ATOM 895 CB ARG A 57 5.018 -0.726 -24.797 1.00 0.00 C ATOM 896 CG ARG A 57 6.409 -0.309 -25.265 1.00 0.00 C ATOM 897 CD ARG A 57 6.747 -1.001 -26.591 1.00 0.00 C ATOM 898 NE ARG A 57 7.398 -2.281 -26.333 1.00 0.00 N ATOM 899 CZ ARG A 57 8.646 -2.333 -25.875 1.00 0.00 C ATOM 900 NH1 ARG A 57 9.310 -1.229 -25.658 1.00 0.00 N ATOM 901 NH2 ARG A 57 9.210 -3.487 -25.640 1.00 0.00 N ATOM 0 H ARG A 57 2.906 -1.073 -23.669 1.00 0.00 H new ATOM 0 HA ARG A 57 5.528 -0.947 -22.714 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.883 -1.799 -24.936 1.00 0.00 H new ATOM 0 HB3 ARG A 57 4.257 -0.229 -25.399 1.00 0.00 H new ATOM 0 HG2 ARG A 57 6.450 0.773 -25.389 1.00 0.00 H new ATOM 0 HG3 ARG A 57 7.150 -0.572 -24.509 1.00 0.00 H new ATOM 0 HD2 ARG A 57 5.838 -1.156 -27.172 1.00 0.00 H new ATOM 0 HD3 ARG A 57 7.401 -0.364 -27.187 1.00 0.00 H new ATOM 0 HE ARG A 57 6.889 -3.148 -26.506 1.00 0.00 H new ATOM 0 HH11 ARG A 57 8.872 -0.326 -25.840 1.00 0.00 H new ATOM 0 HH12 ARG A 57 10.267 -1.270 -25.307 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.694 -4.351 -25.808 1.00 0.00 H new ATOM 0 HH22 ARG A 57 10.167 -3.525 -25.289 1.00 0.00 H new ATOM 915 N LYS A 58 4.247 1.978 -23.533 1.00 0.00 N ATOM 916 CA LYS A 58 4.446 3.409 -23.359 1.00 0.00 C ATOM 917 C LYS A 58 4.449 3.773 -21.877 1.00 0.00 C ATOM 918 O LYS A 58 5.275 4.566 -21.422 1.00 0.00 O ATOM 919 CB LYS A 58 3.336 4.185 -24.073 1.00 0.00 C ATOM 920 CG LYS A 58 3.776 5.638 -24.278 1.00 0.00 C ATOM 921 CD LYS A 58 2.710 6.383 -25.080 1.00 0.00 C ATOM 922 CE LYS A 58 3.231 7.773 -25.446 1.00 0.00 C ATOM 923 NZ LYS A 58 4.325 7.630 -26.449 1.00 0.00 N ATOM 0 H LYS A 58 3.375 1.719 -23.994 1.00 0.00 H new ATOM 0 HA LYS A 58 5.410 3.676 -23.791 1.00 0.00 H new ATOM 0 HB2 LYS A 58 3.115 3.722 -25.035 1.00 0.00 H new ATOM 0 HB3 LYS A 58 2.419 4.152 -23.485 1.00 0.00 H new ATOM 0 HG2 LYS A 58 3.927 6.123 -23.314 1.00 0.00 H new ATOM 0 HG3 LYS A 58 4.730 5.670 -24.803 1.00 0.00 H new ATOM 0 HD2 LYS A 58 2.463 5.825 -25.983 1.00 0.00 H new ATOM 0 HD3 LYS A 58 1.793 6.468 -24.497 1.00 0.00 H new ATOM 0 HE2 LYS A 58 2.424 8.383 -25.853 1.00 0.00 H new ATOM 0 HE3 LYS A 58 3.600 8.284 -24.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 4.410 8.509 -26.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 5.222 7.440 -25.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 4.107 6.841 -27.091 1.00 0.00 H new ATOM 937 N PHE A 59 3.509 3.194 -21.136 1.00 0.00 N ATOM 938 CA PHE A 59 3.394 3.463 -19.707 1.00 0.00 C ATOM 939 C PHE A 59 4.672 3.068 -18.978 1.00 0.00 C ATOM 940 O PHE A 59 5.190 3.825 -18.157 1.00 0.00 O ATOM 941 CB PHE A 59 2.214 2.683 -19.120 1.00 0.00 C ATOM 942 CG PHE A 59 2.063 3.022 -17.654 1.00 0.00 C ATOM 943 CD1 PHE A 59 1.316 4.142 -17.269 1.00 0.00 C ATOM 944 CD2 PHE A 59 2.673 2.221 -16.680 1.00 0.00 C ATOM 945 CE1 PHE A 59 1.176 4.460 -15.912 1.00 0.00 C ATOM 946 CE2 PHE A 59 2.533 2.539 -15.323 1.00 0.00 C ATOM 947 CZ PHE A 59 1.785 3.658 -14.939 1.00 0.00 C ATOM 0 H PHE A 59 2.818 2.538 -21.500 1.00 0.00 H new ATOM 0 HA PHE A 59 3.229 4.532 -19.575 1.00 0.00 H new ATOM 0 HB2 PHE A 59 1.298 2.930 -19.657 1.00 0.00 H new ATOM 0 HB3 PHE A 59 2.376 1.612 -19.241 1.00 0.00 H new ATOM 0 HD1 PHE A 59 0.847 4.761 -18.019 1.00 0.00 H new ATOM 0 HD2 PHE A 59 3.251 1.358 -16.975 1.00 0.00 H new ATOM 0 HE1 PHE A 59 0.599 5.323 -15.616 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.003 1.920 -14.573 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.678 3.903 -13.893 1.00 0.00 H new ATOM 957 N LEU A 60 5.175 1.876 -19.284 1.00 0.00 N ATOM 958 CA LEU A 60 6.392 1.393 -18.645 1.00 0.00 C ATOM 959 C LEU A 60 7.579 2.279 -19.013 1.00 0.00 C ATOM 960 O LEU A 60 8.425 2.574 -18.169 1.00 0.00 O ATOM 961 CB LEU A 60 6.676 -0.067 -19.062 1.00 0.00 C ATOM 962 CG LEU A 60 5.950 -1.058 -18.132 1.00 0.00 C ATOM 963 CD1 LEU A 60 4.459 -1.110 -18.468 1.00 0.00 C ATOM 964 CD2 LEU A 60 6.542 -2.452 -18.321 1.00 0.00 C ATOM 0 H LEU A 60 4.764 1.234 -19.962 1.00 0.00 H new ATOM 0 HA LEU A 60 6.248 1.431 -17.565 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.352 -0.225 -20.091 1.00 0.00 H new ATOM 0 HB3 LEU A 60 7.749 -0.255 -19.033 1.00 0.00 H new ATOM 0 HG LEU A 60 6.076 -0.727 -17.101 1.00 0.00 H new ATOM 0 HD11 LEU A 60 3.960 -1.814 -17.802 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.023 -0.119 -18.341 1.00 0.00 H new ATOM 0 HD13 LEU A 60 4.330 -1.433 -19.501 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.031 -3.156 -17.665 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.415 -2.764 -19.358 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.604 -2.433 -18.076 1.00 0.00 H new ATOM 976 N SER A 61 7.655 2.682 -20.273 1.00 0.00 N ATOM 977 CA SER A 61 8.763 3.508 -20.718 1.00 0.00 C ATOM 978 C SER A 61 8.879 4.756 -19.855 1.00 0.00 C ATOM 979 O SER A 61 9.965 5.105 -19.391 1.00 0.00 O ATOM 980 CB SER A 61 8.535 3.913 -22.171 1.00 0.00 C ATOM 981 OG SER A 61 8.513 2.748 -22.984 1.00 0.00 O ATOM 0 H SER A 61 6.972 2.453 -20.995 1.00 0.00 H new ATOM 0 HA SER A 61 9.687 2.937 -20.631 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.594 4.455 -22.266 1.00 0.00 H new ATOM 0 HB3 SER A 61 9.326 4.586 -22.501 1.00 0.00 H new ATOM 0 HG SER A 61 7.622 2.341 -22.949 1.00 0.00 H new ATOM 987 N LYS A 62 7.753 5.417 -19.631 1.00 0.00 N ATOM 988 CA LYS A 62 7.742 6.620 -18.812 1.00 0.00 C ATOM 989 C LYS A 62 8.045 6.284 -17.359 1.00 0.00 C ATOM 990 O LYS A 62 8.792 6.996 -16.690 1.00 0.00 O ATOM 991 CB LYS A 62 6.378 7.307 -18.912 1.00 0.00 C ATOM 992 CG LYS A 62 6.123 7.763 -20.358 1.00 0.00 C ATOM 993 CD LYS A 62 6.785 9.125 -20.620 1.00 0.00 C ATOM 994 CE LYS A 62 6.608 9.497 -22.094 1.00 0.00 C ATOM 995 NZ LYS A 62 5.162 9.720 -22.378 1.00 0.00 N ATOM 0 H LYS A 62 6.843 5.144 -20.001 1.00 0.00 H new ATOM 0 HA LYS A 62 8.514 7.295 -19.181 1.00 0.00 H new ATOM 0 HB2 LYS A 62 5.592 6.621 -18.594 1.00 0.00 H new ATOM 0 HB3 LYS A 62 6.344 8.165 -18.240 1.00 0.00 H new ATOM 0 HG2 LYS A 62 6.516 7.022 -21.054 1.00 0.00 H new ATOM 0 HG3 LYS A 62 5.050 7.833 -20.539 1.00 0.00 H new ATOM 0 HD2 LYS A 62 6.337 9.888 -19.984 1.00 0.00 H new ATOM 0 HD3 LYS A 62 7.845 9.082 -20.368 1.00 0.00 H new ATOM 0 HE2 LYS A 62 7.178 10.397 -22.324 1.00 0.00 H new ATOM 0 HE3 LYS A 62 6.997 8.702 -22.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 5.060 10.227 -23.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 4.675 8.803 -22.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 4.741 10.286 -21.614 1.00 0.00 H new ATOM 1009 N LEU A 63 7.459 5.198 -16.873 1.00 0.00 N ATOM 1010 CA LEU A 63 7.681 4.793 -15.491 1.00 0.00 C ATOM 1011 C LEU A 63 9.151 4.483 -15.259 1.00 0.00 C ATOM 1012 O LEU A 63 9.729 4.881 -14.249 1.00 0.00 O ATOM 1013 CB LEU A 63 6.828 3.560 -15.160 1.00 0.00 C ATOM 1014 CG LEU A 63 7.091 3.082 -13.720 1.00 0.00 C ATOM 1015 CD1 LEU A 63 6.868 4.233 -12.728 1.00 0.00 C ATOM 1016 CD2 LEU A 63 6.121 1.936 -13.392 1.00 0.00 C ATOM 0 H LEU A 63 6.836 4.590 -17.405 1.00 0.00 H new ATOM 0 HA LEU A 63 7.389 5.615 -14.837 1.00 0.00 H new ATOM 0 HB2 LEU A 63 5.772 3.800 -15.281 1.00 0.00 H new ATOM 0 HB3 LEU A 63 7.054 2.757 -15.861 1.00 0.00 H new ATOM 0 HG LEU A 63 8.123 2.740 -13.637 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.057 3.881 -11.714 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.549 5.051 -12.961 1.00 0.00 H new ATOM 0 HD13 LEU A 63 5.839 4.584 -12.804 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.298 1.589 -12.374 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.094 2.292 -13.481 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.281 1.113 -14.089 1.00 0.00 H new ATOM 1028 N MET A 64 9.752 3.767 -16.201 1.00 0.00 N ATOM 1029 CA MET A 64 11.158 3.402 -16.083 1.00 0.00 C ATOM 1030 C MET A 64 12.040 4.649 -16.118 1.00 0.00 C ATOM 1031 O MET A 64 13.001 4.768 -15.354 1.00 0.00 O ATOM 1032 CB MET A 64 11.540 2.442 -17.226 1.00 0.00 C ATOM 1033 CG MET A 64 12.695 1.528 -16.793 1.00 0.00 C ATOM 1034 SD MET A 64 14.189 2.515 -16.528 1.00 0.00 S ATOM 1035 CE MET A 64 15.384 1.267 -17.071 1.00 0.00 C ATOM 0 H MET A 64 9.293 3.430 -17.047 1.00 0.00 H new ATOM 0 HA MET A 64 11.316 2.901 -15.128 1.00 0.00 H new ATOM 0 HB2 MET A 64 10.676 1.839 -17.507 1.00 0.00 H new ATOM 0 HB3 MET A 64 11.831 3.013 -18.108 1.00 0.00 H new ATOM 0 HG2 MET A 64 12.430 1.000 -15.877 1.00 0.00 H new ATOM 0 HG3 MET A 64 12.878 0.771 -17.556 1.00 0.00 H new ATOM 0 HE1 MET A 64 16.358 1.479 -16.629 1.00 0.00 H new ATOM 0 HE2 MET A 64 15.049 0.280 -16.754 1.00 0.00 H new ATOM 0 HE3 MET A 64 15.466 1.290 -18.158 1.00 0.00 H new ATOM 1045 N ASP A 65 11.703 5.579 -17.006 1.00 0.00 N ATOM 1046 CA ASP A 65 12.468 6.813 -17.131 1.00 0.00 C ATOM 1047 C ASP A 65 12.405 7.619 -15.839 1.00 0.00 C ATOM 1048 O ASP A 65 13.402 8.200 -15.411 1.00 0.00 O ATOM 1049 CB ASP A 65 11.918 7.648 -18.287 1.00 0.00 C ATOM 1050 CG ASP A 65 12.876 8.790 -18.600 1.00 0.00 C ATOM 1051 OD1 ASP A 65 12.963 9.703 -17.795 1.00 0.00 O ATOM 1052 OD2 ASP A 65 13.512 8.736 -19.641 1.00 0.00 O ATOM 0 H ASP A 65 10.911 5.502 -17.645 1.00 0.00 H new ATOM 0 HA ASP A 65 13.509 6.556 -17.330 1.00 0.00 H new ATOM 0 HB2 ASP A 65 11.784 7.021 -19.169 1.00 0.00 H new ATOM 0 HB3 ASP A 65 10.937 8.045 -18.026 1.00 0.00 H new ATOM 1057 N GLN A 66 11.227 7.646 -15.220 1.00 0.00 N ATOM 1058 CA GLN A 66 11.054 8.383 -13.973 1.00 0.00 C ATOM 1059 C GLN A 66 11.914 7.775 -12.869 1.00 0.00 C ATOM 1060 O GLN A 66 12.496 8.495 -12.058 1.00 0.00 O ATOM 1061 CB GLN A 66 9.577 8.381 -13.550 1.00 0.00 C ATOM 1062 CG GLN A 66 8.814 9.467 -14.315 1.00 0.00 C ATOM 1063 CD GLN A 66 7.359 9.501 -13.864 1.00 0.00 C ATOM 1064 OE1 GLN A 66 6.852 8.524 -13.315 1.00 0.00 O ATOM 1065 NE2 GLN A 66 6.652 10.579 -14.070 1.00 0.00 N ATOM 0 H GLN A 66 10.389 7.172 -15.557 1.00 0.00 H new ATOM 0 HA GLN A 66 11.372 9.413 -14.137 1.00 0.00 H new ATOM 0 HB2 GLN A 66 9.134 7.405 -13.748 1.00 0.00 H new ATOM 0 HB3 GLN A 66 9.497 8.555 -12.477 1.00 0.00 H new ATOM 0 HG2 GLN A 66 9.279 10.438 -14.144 1.00 0.00 H new ATOM 0 HG3 GLN A 66 8.866 9.273 -15.386 1.00 0.00 H new ATOM 0 HE21 GLN A 66 7.076 11.387 -14.526 1.00 0.00 H new ATOM 0 HE22 GLN A 66 5.676 10.613 -13.775 1.00 0.00 H new ATOM 1074 N LEU A 67 11.992 6.450 -12.840 1.00 0.00 N ATOM 1075 CA LEU A 67 12.788 5.768 -11.829 1.00 0.00 C ATOM 1076 C LEU A 67 14.256 6.171 -11.948 1.00 0.00 C ATOM 1077 O LEU A 67 14.932 6.404 -10.945 1.00 0.00 O ATOM 1078 CB LEU A 67 12.642 4.244 -12.012 1.00 0.00 C ATOM 1079 CG LEU A 67 11.358 3.739 -11.318 1.00 0.00 C ATOM 1080 CD1 LEU A 67 10.858 2.462 -12.008 1.00 0.00 C ATOM 1081 CD2 LEU A 67 11.658 3.419 -9.847 1.00 0.00 C ATOM 0 H LEU A 67 11.518 5.832 -13.499 1.00 0.00 H new ATOM 0 HA LEU A 67 12.432 6.053 -10.839 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.609 4.000 -13.074 1.00 0.00 H new ATOM 0 HB3 LEU A 67 13.512 3.736 -11.595 1.00 0.00 H new ATOM 0 HG LEU A 67 10.595 4.515 -11.383 1.00 0.00 H new ATOM 0 HD11 LEU A 67 9.952 2.112 -11.513 1.00 0.00 H new ATOM 0 HD12 LEU A 67 10.640 2.675 -13.055 1.00 0.00 H new ATOM 0 HD13 LEU A 67 11.626 1.691 -11.947 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.750 3.063 -9.360 1.00 0.00 H new ATOM 0 HD22 LEU A 67 12.426 2.648 -9.792 1.00 0.00 H new ATOM 0 HD23 LEU A 67 12.011 4.319 -9.344 1.00 0.00 H new ATOM 1093 N GLU A 68 14.748 6.246 -13.177 1.00 0.00 N ATOM 1094 CA GLU A 68 16.139 6.611 -13.404 1.00 0.00 C ATOM 1095 C GLU A 68 16.409 8.035 -12.923 1.00 0.00 C ATOM 1096 O GLU A 68 17.385 8.287 -12.216 1.00 0.00 O ATOM 1097 CB GLU A 68 16.450 6.513 -14.893 1.00 0.00 C ATOM 1098 CG GLU A 68 16.330 5.055 -15.343 1.00 0.00 C ATOM 1099 CD GLU A 68 16.500 4.966 -16.856 1.00 0.00 C ATOM 1100 OE1 GLU A 68 16.689 6.003 -17.472 1.00 0.00 O ATOM 1101 OE2 GLU A 68 16.434 3.866 -17.376 1.00 0.00 O ATOM 0 H GLU A 68 14.211 6.061 -14.024 1.00 0.00 H new ATOM 0 HA GLU A 68 16.776 5.927 -12.843 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.761 7.138 -15.461 1.00 0.00 H new ATOM 0 HB3 GLU A 68 17.455 6.885 -15.091 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.087 4.448 -14.846 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.359 4.654 -15.053 1.00 0.00 H new ATOM 1108 N ALA A 69 15.542 8.960 -13.316 1.00 0.00 N ATOM 1109 CA ALA A 69 15.706 10.355 -12.925 1.00 0.00 C ATOM 1110 C ALA A 69 15.685 10.486 -11.410 1.00 0.00 C ATOM 1111 O ALA A 69 16.497 11.203 -10.831 1.00 0.00 O ATOM 1112 CB ALA A 69 14.573 11.199 -13.511 1.00 0.00 C ATOM 0 H ALA A 69 14.726 8.773 -13.899 1.00 0.00 H new ATOM 0 HA ALA A 69 16.664 10.707 -13.306 1.00 0.00 H new ATOM 0 HB1 ALA A 69 14.703 12.240 -13.214 1.00 0.00 H new ATOM 0 HB2 ALA A 69 14.591 11.127 -14.598 1.00 0.00 H new ATOM 0 HB3 ALA A 69 13.616 10.833 -13.139 1.00 0.00 H new ATOM 1118 N LEU A 70 14.753 9.797 -10.770 1.00 0.00 N ATOM 1119 CA LEU A 70 14.648 9.867 -9.320 1.00 0.00 C ATOM 1120 C LEU A 70 15.928 9.344 -8.690 1.00 0.00 C ATOM 1121 O LEU A 70 16.445 9.913 -7.723 1.00 0.00 O ATOM 1122 CB LEU A 70 13.443 9.033 -8.846 1.00 0.00 C ATOM 1123 CG LEU A 70 12.871 9.581 -7.520 1.00 0.00 C ATOM 1124 CD1 LEU A 70 13.962 9.616 -6.443 1.00 0.00 C ATOM 1125 CD2 LEU A 70 12.279 10.998 -7.731 1.00 0.00 C ATOM 0 H LEU A 70 14.068 9.192 -11.223 1.00 0.00 H new ATOM 0 HA LEU A 70 14.501 10.903 -9.016 1.00 0.00 H new ATOM 0 HB2 LEU A 70 12.667 9.043 -9.611 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.746 7.995 -8.713 1.00 0.00 H new ATOM 0 HG LEU A 70 12.073 8.917 -7.187 1.00 0.00 H new ATOM 0 HD11 LEU A 70 13.544 10.004 -5.514 1.00 0.00 H new ATOM 0 HD12 LEU A 70 14.341 8.608 -6.277 1.00 0.00 H new ATOM 0 HD13 LEU A 70 14.777 10.261 -6.772 1.00 0.00 H new ATOM 0 HD21 LEU A 70 11.880 11.370 -6.787 1.00 0.00 H new ATOM 0 HD22 LEU A 70 13.061 11.670 -8.084 1.00 0.00 H new ATOM 0 HD23 LEU A 70 11.479 10.952 -8.470 1.00 0.00 H new ATOM 1137 N LYS A 71 16.444 8.256 -9.245 1.00 0.00 N ATOM 1138 CA LYS A 71 17.659 7.671 -8.721 1.00 0.00 C ATOM 1139 C LYS A 71 18.763 8.731 -8.710 1.00 0.00 C ATOM 1140 O LYS A 71 19.526 8.832 -7.753 1.00 0.00 O ATOM 1141 CB LYS A 71 18.063 6.460 -9.580 1.00 0.00 C ATOM 1142 CG LYS A 71 18.749 5.404 -8.707 1.00 0.00 C ATOM 1143 CD LYS A 71 19.374 4.324 -9.585 1.00 0.00 C ATOM 1144 CE LYS A 71 19.973 3.241 -8.691 1.00 0.00 C ATOM 1145 NZ LYS A 71 20.567 2.174 -9.540 1.00 0.00 N ATOM 0 H LYS A 71 16.043 7.770 -10.047 1.00 0.00 H new ATOM 0 HA LYS A 71 17.498 7.325 -7.700 1.00 0.00 H new ATOM 0 HB2 LYS A 71 17.182 6.032 -10.058 1.00 0.00 H new ATOM 0 HB3 LYS A 71 18.735 6.777 -10.377 1.00 0.00 H new ATOM 0 HG2 LYS A 71 19.517 5.873 -8.091 1.00 0.00 H new ATOM 0 HG3 LYS A 71 18.024 4.956 -8.027 1.00 0.00 H new ATOM 0 HD2 LYS A 71 18.621 3.893 -10.245 1.00 0.00 H new ATOM 0 HD3 LYS A 71 20.146 4.756 -10.221 1.00 0.00 H new ATOM 0 HE2 LYS A 71 20.735 3.671 -8.041 1.00 0.00 H new ATOM 0 HE3 LYS A 71 19.203 2.820 -8.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 20.976 1.435 -8.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 19.828 1.758 -10.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 21.313 2.582 -10.139 1.00 0.00 H new ATOM 1159 N LYS A 72 18.831 9.531 -9.773 1.00 0.00 N ATOM 1160 CA LYS A 72 19.826 10.586 -9.858 1.00 0.00 C ATOM 1161 C LYS A 72 19.622 11.640 -8.774 1.00 0.00 C ATOM 1162 O LYS A 72 20.579 12.086 -8.143 1.00 0.00 O ATOM 1163 CB LYS A 72 19.748 11.242 -11.217 1.00 0.00 C ATOM 1164 CG LYS A 72 20.851 12.278 -11.323 1.00 0.00 C ATOM 1165 CD LYS A 72 20.897 12.755 -12.754 1.00 0.00 C ATOM 1166 CE LYS A 72 21.983 13.819 -12.913 1.00 0.00 C ATOM 1167 NZ LYS A 72 21.535 15.097 -12.280 1.00 0.00 N ATOM 0 H LYS A 72 18.211 9.466 -10.580 1.00 0.00 H new ATOM 0 HA LYS A 72 20.808 10.136 -9.711 1.00 0.00 H new ATOM 0 HB2 LYS A 72 19.855 10.495 -12.004 1.00 0.00 H new ATOM 0 HB3 LYS A 72 18.774 11.712 -11.354 1.00 0.00 H new ATOM 0 HG2 LYS A 72 20.658 13.112 -10.648 1.00 0.00 H new ATOM 0 HG3 LYS A 72 21.809 11.847 -11.032 1.00 0.00 H new ATOM 0 HD2 LYS A 72 21.098 11.916 -13.420 1.00 0.00 H new ATOM 0 HD3 LYS A 72 19.929 13.165 -13.041 1.00 0.00 H new ATOM 0 HE2 LYS A 72 22.909 13.478 -12.450 1.00 0.00 H new ATOM 0 HE3 LYS A 72 22.195 13.981 -13.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 22.175 15.867 -12.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 20.568 15.319 -12.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 21.550 14.996 -11.245 1.00 0.00 H new ATOM 1181 N GLN A 73 18.372 12.045 -8.574 1.00 0.00 N ATOM 1182 CA GLN A 73 18.057 13.062 -7.574 1.00 0.00 C ATOM 1183 C GLN A 73 18.698 12.716 -6.240 1.00 0.00 C ATOM 1184 O GLN A 73 19.435 13.517 -5.665 1.00 0.00 O ATOM 1185 CB GLN A 73 16.544 13.151 -7.381 1.00 0.00 C ATOM 1186 CG GLN A 73 15.880 13.647 -8.663 1.00 0.00 C ATOM 1187 CD GLN A 73 16.217 15.112 -8.901 1.00 0.00 C ATOM 1188 OE1 GLN A 73 16.460 15.859 -7.952 1.00 0.00 O ATOM 1189 NE2 GLN A 73 16.225 15.576 -10.119 1.00 0.00 N ATOM 0 H GLN A 73 17.565 11.688 -9.086 1.00 0.00 H new ATOM 0 HA GLN A 73 18.446 14.017 -7.926 1.00 0.00 H new ATOM 0 HB2 GLN A 73 16.146 12.173 -7.111 1.00 0.00 H new ATOM 0 HB3 GLN A 73 16.314 13.827 -6.558 1.00 0.00 H new ATOM 0 HG2 GLN A 73 16.215 13.048 -9.509 1.00 0.00 H new ATOM 0 HG3 GLN A 73 14.799 13.522 -8.592 1.00 0.00 H new ATOM 0 HE21 GLN A 73 16.023 14.955 -10.903 1.00 0.00 H new ATOM 0 HE22 GLN A 73 16.433 16.560 -10.288 1.00 0.00 H new ATOM 1198 N LEU A 74 18.408 11.520 -5.746 1.00 0.00 N ATOM 1199 CA LEU A 74 18.960 11.096 -4.469 1.00 0.00 C ATOM 1200 C LEU A 74 20.469 10.925 -4.567 1.00 0.00 C ATOM 1201 O LEU A 74 21.193 11.159 -3.598 1.00 0.00 O ATOM 1202 CB LEU A 74 18.317 9.778 -4.042 1.00 0.00 C ATOM 1203 CG LEU A 74 16.787 9.919 -3.994 1.00 0.00 C ATOM 1204 CD1 LEU A 74 16.143 8.532 -4.091 1.00 0.00 C ATOM 1205 CD2 LEU A 74 16.373 10.572 -2.668 1.00 0.00 C ATOM 0 H LEU A 74 17.804 10.837 -6.202 1.00 0.00 H new ATOM 0 HA LEU A 74 18.746 11.863 -3.725 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.594 8.988 -4.740 1.00 0.00 H new ATOM 0 HB3 LEU A 74 18.692 9.484 -3.062 1.00 0.00 H new ATOM 0 HG LEU A 74 16.456 10.538 -4.828 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.058 8.631 -4.057 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.435 8.060 -5.029 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.477 7.916 -3.256 1.00 0.00 H new ATOM 0 HD21 LEU A 74 15.288 10.672 -2.635 1.00 0.00 H new ATOM 0 HD22 LEU A 74 16.706 9.950 -1.837 1.00 0.00 H new ATOM 0 HD23 LEU A 74 16.831 11.558 -2.590 1.00 0.00 H new ATOM 1217 N GLY A 75 20.937 10.530 -5.745 1.00 0.00 N ATOM 1218 CA GLY A 75 22.365 10.350 -5.976 1.00 0.00 C ATOM 1219 C GLY A 75 23.034 9.564 -4.849 1.00 0.00 C ATOM 1220 O GLY A 75 23.229 8.355 -4.954 1.00 0.00 O ATOM 0 H GLY A 75 20.349 10.328 -6.554 1.00 0.00 H new ATOM 0 HA2 GLY A 75 22.516 9.828 -6.921 1.00 0.00 H new ATOM 0 HA3 GLY A 75 22.842 11.325 -6.071 1.00 0.00 H new ATOM 1224 N ASP A 76 23.401 10.270 -3.781 1.00 0.00 N ATOM 1225 CA ASP A 76 24.081 9.641 -2.651 1.00 0.00 C ATOM 1226 C ASP A 76 23.080 9.084 -1.649 1.00 0.00 C ATOM 1227 O ASP A 76 22.763 9.729 -0.650 1.00 0.00 O ATOM 1228 CB ASP A 76 24.979 10.666 -1.954 1.00 0.00 C ATOM 1229 CG ASP A 76 26.043 11.174 -2.918 1.00 0.00 C ATOM 1230 OD1 ASP A 76 26.708 10.351 -3.527 1.00 0.00 O ATOM 1231 OD2 ASP A 76 26.180 12.381 -3.037 1.00 0.00 O ATOM 0 H ASP A 76 23.240 11.272 -3.675 1.00 0.00 H new ATOM 0 HA ASP A 76 24.683 8.817 -3.033 1.00 0.00 H new ATOM 0 HB2 ASP A 76 24.378 11.500 -1.592 1.00 0.00 H new ATOM 0 HB3 ASP A 76 25.453 10.213 -1.083 1.00 0.00 H new ATOM 1236 N ASN A 77 22.592 7.876 -1.921 1.00 0.00 N ATOM 1237 CA ASN A 77 21.631 7.225 -1.037 1.00 0.00 C ATOM 1238 C ASN A 77 21.880 5.725 -0.979 1.00 0.00 C ATOM 1239 O ASN A 77 21.810 5.031 -1.994 1.00 0.00 O ATOM 1240 CB ASN A 77 20.219 7.491 -1.531 1.00 0.00 C ATOM 1241 CG ASN A 77 19.203 7.117 -0.464 1.00 0.00 C ATOM 1242 OD1 ASN A 77 19.304 6.056 0.153 1.00 0.00 O ATOM 1243 ND2 ASN A 77 18.226 7.938 -0.209 1.00 0.00 N ATOM 0 H ASN A 77 22.846 7.330 -2.744 1.00 0.00 H new ATOM 0 HA ASN A 77 21.751 7.634 -0.034 1.00 0.00 H new ATOM 0 HB2 ASN A 77 20.111 8.544 -1.792 1.00 0.00 H new ATOM 0 HB3 ASN A 77 20.031 6.917 -2.438 1.00 0.00 H new ATOM 0 HD21 ASN A 77 17.537 7.705 0.506 1.00 0.00 H new ATOM 0 HD22 ASN A 77 18.149 8.815 -0.724 1.00 0.00 H new ATOM 1250 N GLU A 78 22.171 5.240 0.220 1.00 0.00 N ATOM 1251 CA GLU A 78 22.433 3.823 0.420 1.00 0.00 C ATOM 1252 C GLU A 78 21.143 3.017 0.308 1.00 0.00 C ATOM 1253 O GLU A 78 21.161 1.856 -0.091 1.00 0.00 O ATOM 1254 CB GLU A 78 23.081 3.599 1.789 1.00 0.00 C ATOM 1255 CG GLU A 78 24.112 4.700 2.043 1.00 0.00 C ATOM 1256 CD GLU A 78 25.145 4.717 0.921 1.00 0.00 C ATOM 1257 OE1 GLU A 78 26.066 3.921 0.977 1.00 0.00 O ATOM 1258 OE2 GLU A 78 24.991 5.519 0.014 1.00 0.00 O ATOM 0 H GLU A 78 22.231 5.806 1.067 1.00 0.00 H new ATOM 0 HA GLU A 78 23.118 3.483 -0.357 1.00 0.00 H new ATOM 0 HB2 GLU A 78 22.321 3.608 2.570 1.00 0.00 H new ATOM 0 HB3 GLU A 78 23.560 2.621 1.822 1.00 0.00 H new ATOM 0 HG2 GLU A 78 23.615 5.668 2.105 1.00 0.00 H new ATOM 0 HG3 GLU A 78 24.606 4.533 3.000 1.00 0.00 H new ATOM 1265 N ALA A 79 20.028 3.638 0.670 1.00 0.00 N ATOM 1266 CA ALA A 79 18.737 2.963 0.619 1.00 0.00 C ATOM 1267 C ALA A 79 18.379 2.555 -0.810 1.00 0.00 C ATOM 1268 O ALA A 79 17.795 1.496 -1.032 1.00 0.00 O ATOM 1269 CB ALA A 79 17.651 3.880 1.178 1.00 0.00 C ATOM 0 H ALA A 79 19.991 4.602 1.000 1.00 0.00 H new ATOM 0 HA ALA A 79 18.805 2.059 1.225 1.00 0.00 H new ATOM 0 HB1 ALA A 79 16.688 3.371 1.137 1.00 0.00 H new ATOM 0 HB2 ALA A 79 17.885 4.132 2.212 1.00 0.00 H new ATOM 0 HB3 ALA A 79 17.604 4.793 0.584 1.00 0.00 H new ATOM 1275 N ILE A 80 18.728 3.402 -1.775 1.00 0.00 N ATOM 1276 CA ILE A 80 18.429 3.117 -3.179 1.00 0.00 C ATOM 1277 C ILE A 80 19.552 2.289 -3.806 1.00 0.00 C ATOM 1278 O ILE A 80 19.303 1.274 -4.455 1.00 0.00 O ATOM 1279 CB ILE A 80 18.273 4.463 -3.927 1.00 0.00 C ATOM 1280 CG1 ILE A 80 16.811 4.920 -3.907 1.00 0.00 C ATOM 1281 CG2 ILE A 80 18.721 4.361 -5.394 1.00 0.00 C ATOM 1282 CD1 ILE A 80 16.336 5.113 -2.469 1.00 0.00 C ATOM 0 H ILE A 80 19.214 4.284 -1.615 1.00 0.00 H new ATOM 0 HA ILE A 80 17.507 2.541 -3.252 1.00 0.00 H new ATOM 0 HB ILE A 80 18.908 5.183 -3.410 1.00 0.00 H new ATOM 0 HG12 ILE A 80 16.707 5.854 -4.460 1.00 0.00 H new ATOM 0 HG13 ILE A 80 16.185 4.181 -4.408 1.00 0.00 H new ATOM 0 HG21 ILE A 80 18.595 5.328 -5.881 1.00 0.00 H new ATOM 0 HG22 ILE A 80 19.770 4.069 -5.435 1.00 0.00 H new ATOM 0 HG23 ILE A 80 18.116 3.614 -5.908 1.00 0.00 H new ATOM 0 HD11 ILE A 80 15.296 5.438 -2.470 1.00 0.00 H new ATOM 0 HD12 ILE A 80 16.421 4.171 -1.928 1.00 0.00 H new ATOM 0 HD13 ILE A 80 16.951 5.869 -1.981 1.00 0.00 H new ATOM 1294 N THR A 81 20.785 2.749 -3.634 1.00 0.00 N ATOM 1295 CA THR A 81 21.919 2.057 -4.224 1.00 0.00 C ATOM 1296 C THR A 81 22.058 0.665 -3.633 1.00 0.00 C ATOM 1297 O THR A 81 22.466 -0.273 -4.320 1.00 0.00 O ATOM 1298 CB THR A 81 23.202 2.860 -3.992 1.00 0.00 C ATOM 1299 OG1 THR A 81 23.400 3.044 -2.600 1.00 0.00 O ATOM 1300 CG2 THR A 81 23.087 4.226 -4.677 1.00 0.00 C ATOM 0 H THR A 81 21.021 3.585 -3.099 1.00 0.00 H new ATOM 0 HA THR A 81 21.750 1.962 -5.297 1.00 0.00 H new ATOM 0 HB THR A 81 24.048 2.316 -4.411 1.00 0.00 H new ATOM 0 HG1 THR A 81 23.048 3.918 -2.332 1.00 0.00 H new ATOM 0 HG21 THR A 81 24.002 4.795 -4.510 1.00 0.00 H new ATOM 0 HG22 THR A 81 22.938 4.085 -5.747 1.00 0.00 H new ATOM 0 HG23 THR A 81 22.240 4.771 -4.261 1.00 0.00 H new ATOM 1308 N GLN A 82 21.711 0.530 -2.357 1.00 0.00 N ATOM 1309 CA GLN A 82 21.794 -0.758 -1.673 1.00 0.00 C ATOM 1310 C GLN A 82 20.417 -1.153 -1.143 1.00 0.00 C ATOM 1311 O GLN A 82 19.879 -0.507 -0.247 1.00 0.00 O ATOM 1312 CB GLN A 82 22.788 -0.651 -0.516 1.00 0.00 C ATOM 1313 CG GLN A 82 24.015 0.144 -0.968 1.00 0.00 C ATOM 1314 CD GLN A 82 25.065 0.158 0.136 1.00 0.00 C ATOM 1315 OE1 GLN A 82 25.384 -0.887 0.701 1.00 0.00 O ATOM 1316 NE2 GLN A 82 25.622 1.287 0.478 1.00 0.00 N ATOM 0 H GLN A 82 21.370 1.295 -1.775 1.00 0.00 H new ATOM 0 HA GLN A 82 22.134 -1.522 -2.373 1.00 0.00 H new ATOM 0 HB2 GLN A 82 22.318 -0.161 0.337 1.00 0.00 H new ATOM 0 HB3 GLN A 82 23.087 -1.646 -0.187 1.00 0.00 H new ATOM 0 HG2 GLN A 82 24.432 -0.299 -1.872 1.00 0.00 H new ATOM 0 HG3 GLN A 82 23.725 1.165 -1.218 1.00 0.00 H new ATOM 0 HE21 GLN A 82 25.354 2.151 0.007 1.00 0.00 H new ATOM 0 HE22 GLN A 82 26.325 1.306 1.217 1.00 0.00 H new ATOM 1325 N GLU A 83 19.852 -2.207 -1.713 1.00 0.00 N ATOM 1326 CA GLU A 83 18.537 -2.675 -1.297 1.00 0.00 C ATOM 1327 C GLU A 83 18.579 -3.180 0.139 1.00 0.00 C ATOM 1328 O GLU A 83 17.558 -3.219 0.821 1.00 0.00 O ATOM 1329 CB GLU A 83 18.070 -3.802 -2.223 1.00 0.00 C ATOM 1330 CG GLU A 83 19.234 -4.764 -2.479 1.00 0.00 C ATOM 1331 CD GLU A 83 18.718 -6.044 -3.126 1.00 0.00 C ATOM 1332 OE1 GLU A 83 18.432 -6.011 -4.312 1.00 0.00 O ATOM 1333 OE2 GLU A 83 18.614 -7.037 -2.427 1.00 0.00 O ATOM 0 H GLU A 83 20.280 -2.752 -2.461 1.00 0.00 H new ATOM 0 HA GLU A 83 17.838 -1.841 -1.356 1.00 0.00 H new ATOM 0 HB2 GLU A 83 17.234 -4.337 -1.771 1.00 0.00 H new ATOM 0 HB3 GLU A 83 17.711 -3.388 -3.166 1.00 0.00 H new ATOM 0 HG2 GLU A 83 19.972 -4.291 -3.127 1.00 0.00 H new ATOM 0 HG3 GLU A 83 19.737 -4.998 -1.541 1.00 0.00 H new ATOM 1340 N ILE A 84 19.762 -3.586 0.580 1.00 0.00 N ATOM 1341 CA ILE A 84 19.930 -4.114 1.933 1.00 0.00 C ATOM 1342 C ILE A 84 19.297 -3.166 2.958 1.00 0.00 C ATOM 1343 O ILE A 84 18.352 -3.529 3.665 1.00 0.00 O ATOM 1344 CB ILE A 84 21.435 -4.289 2.250 1.00 0.00 C ATOM 1345 CG1 ILE A 84 22.208 -4.659 0.969 1.00 0.00 C ATOM 1346 CG2 ILE A 84 21.620 -5.397 3.291 1.00 0.00 C ATOM 1347 CD1 ILE A 84 23.659 -5.063 1.294 1.00 0.00 C ATOM 0 H ILE A 84 20.618 -3.561 0.026 1.00 0.00 H new ATOM 0 HA ILE A 84 19.433 -5.082 1.991 1.00 0.00 H new ATOM 0 HB ILE A 84 21.822 -3.349 2.644 1.00 0.00 H new ATOM 0 HG12 ILE A 84 21.704 -5.481 0.461 1.00 0.00 H new ATOM 0 HG13 ILE A 84 22.208 -3.812 0.283 1.00 0.00 H new ATOM 0 HG21 ILE A 84 22.681 -5.516 3.511 1.00 0.00 H new ATOM 0 HG22 ILE A 84 21.088 -5.131 4.204 1.00 0.00 H new ATOM 0 HG23 ILE A 84 21.223 -6.334 2.900 1.00 0.00 H new ATOM 0 HD11 ILE A 84 24.181 -5.319 0.372 1.00 0.00 H new ATOM 0 HD12 ILE A 84 24.168 -4.231 1.780 1.00 0.00 H new ATOM 0 HD13 ILE A 84 23.656 -5.926 1.960 1.00 0.00 H new ATOM 1359 N VAL A 85 19.806 -1.935 3.001 1.00 0.00 N ATOM 1360 CA VAL A 85 19.275 -0.930 3.916 1.00 0.00 C ATOM 1361 C VAL A 85 17.911 -0.452 3.428 1.00 0.00 C ATOM 1362 O VAL A 85 17.035 -0.127 4.228 1.00 0.00 O ATOM 1363 CB VAL A 85 20.265 0.250 4.034 1.00 0.00 C ATOM 1364 CG1 VAL A 85 20.940 0.496 2.681 1.00 0.00 C ATOM 1365 CG2 VAL A 85 19.538 1.528 4.491 1.00 0.00 C ATOM 0 H VAL A 85 20.579 -1.613 2.418 1.00 0.00 H new ATOM 0 HA VAL A 85 19.149 -1.371 4.905 1.00 0.00 H new ATOM 0 HB VAL A 85 21.020 -0.005 4.778 1.00 0.00 H new ATOM 0 HG11 VAL A 85 21.637 1.329 2.768 1.00 0.00 H new ATOM 0 HG12 VAL A 85 21.481 -0.400 2.376 1.00 0.00 H new ATOM 0 HG13 VAL A 85 20.182 0.734 1.934 1.00 0.00 H new ATOM 0 HG21 VAL A 85 20.254 2.346 4.567 1.00 0.00 H new ATOM 0 HG22 VAL A 85 18.767 1.787 3.766 1.00 0.00 H new ATOM 0 HG23 VAL A 85 19.078 1.357 5.464 1.00 0.00 H new ATOM 1375 N GLY A 86 17.740 -0.409 2.116 1.00 0.00 N ATOM 1376 CA GLY A 86 16.477 0.038 1.545 1.00 0.00 C ATOM 1377 C GLY A 86 15.331 -0.849 2.008 1.00 0.00 C ATOM 1378 O GLY A 86 14.268 -0.364 2.397 1.00 0.00 O ATOM 0 H GLY A 86 18.449 -0.674 1.433 1.00 0.00 H new ATOM 0 HA2 GLY A 86 16.285 1.070 1.838 1.00 0.00 H new ATOM 0 HA3 GLY A 86 16.539 0.022 0.457 1.00 0.00 H new ATOM 1382 N CYS A 87 15.557 -2.153 1.976 1.00 0.00 N ATOM 1383 CA CYS A 87 14.541 -3.096 2.406 1.00 0.00 C ATOM 1384 C CYS A 87 14.281 -2.924 3.894 1.00 0.00 C ATOM 1385 O CYS A 87 13.129 -2.883 4.332 1.00 0.00 O ATOM 1386 CB CYS A 87 14.996 -4.530 2.114 1.00 0.00 C ATOM 1387 SG CYS A 87 13.696 -5.685 2.611 1.00 0.00 S ATOM 0 H CYS A 87 16.428 -2.578 1.659 1.00 0.00 H new ATOM 0 HA CYS A 87 13.619 -2.903 1.857 1.00 0.00 H new ATOM 0 HB2 CYS A 87 15.214 -4.645 1.052 1.00 0.00 H new ATOM 0 HB3 CYS A 87 15.917 -4.748 2.654 1.00 0.00 H new ATOM 0 HG CYS A 87 12.776 -5.724 1.693 1.00 0.00 H new ATOM 1393 N ALA A 88 15.358 -2.827 4.672 1.00 0.00 N ATOM 1394 CA ALA A 88 15.221 -2.661 6.114 1.00 0.00 C ATOM 1395 C ALA A 88 14.379 -1.433 6.428 1.00 0.00 C ATOM 1396 O ALA A 88 13.574 -1.442 7.362 1.00 0.00 O ATOM 1397 CB ALA A 88 16.599 -2.511 6.756 1.00 0.00 C ATOM 0 H ALA A 88 16.320 -2.860 4.333 1.00 0.00 H new ATOM 0 HA ALA A 88 14.727 -3.544 6.519 1.00 0.00 H new ATOM 0 HB1 ALA A 88 16.487 -2.387 7.833 1.00 0.00 H new ATOM 0 HB2 ALA A 88 17.194 -3.401 6.553 1.00 0.00 H new ATOM 0 HB3 ALA A 88 17.101 -1.637 6.341 1.00 0.00 H new ATOM 1403 N HIS A 89 14.564 -0.383 5.638 1.00 0.00 N ATOM 1404 CA HIS A 89 13.806 0.844 5.832 1.00 0.00 C ATOM 1405 C HIS A 89 12.321 0.558 5.660 1.00 0.00 C ATOM 1406 O HIS A 89 11.489 1.035 6.430 1.00 0.00 O ATOM 1407 CB HIS A 89 14.268 1.922 4.812 1.00 0.00 C ATOM 1408 CG HIS A 89 13.080 2.603 4.147 1.00 0.00 C ATOM 1409 ND1 HIS A 89 12.598 2.206 2.906 1.00 0.00 N ATOM 1410 CD2 HIS A 89 12.258 3.631 4.549 1.00 0.00 C ATOM 1411 CE1 HIS A 89 11.535 2.983 2.614 1.00 0.00 C ATOM 1412 NE2 HIS A 89 11.287 3.867 3.582 1.00 0.00 N ATOM 0 H HIS A 89 15.227 -0.357 4.863 1.00 0.00 H new ATOM 0 HA HIS A 89 13.982 1.221 6.840 1.00 0.00 H new ATOM 0 HB2 HIS A 89 14.879 2.668 5.320 1.00 0.00 H new ATOM 0 HB3 HIS A 89 14.897 1.459 4.051 1.00 0.00 H new ATOM 0 HD1 HIS A 89 12.979 1.462 2.322 1.00 0.00 H new ATOM 0 HD2 HIS A 89 12.353 4.174 5.478 1.00 0.00 H new ATOM 0 HE1 HIS A 89 10.955 2.900 1.707 1.00 0.00 H new ATOM 1420 N LEU A 90 11.994 -0.179 4.611 1.00 0.00 N ATOM 1421 CA LEU A 90 10.594 -0.461 4.322 1.00 0.00 C ATOM 1422 C LEU A 90 9.959 -1.236 5.467 1.00 0.00 C ATOM 1423 O LEU A 90 8.838 -0.944 5.878 1.00 0.00 O ATOM 1424 CB LEU A 90 10.473 -1.264 3.013 1.00 0.00 C ATOM 1425 CG LEU A 90 9.196 -0.870 2.237 1.00 0.00 C ATOM 1426 CD1 LEU A 90 7.968 -0.914 3.158 1.00 0.00 C ATOM 1427 CD2 LEU A 90 9.355 0.542 1.631 1.00 0.00 C ATOM 0 H LEU A 90 12.662 -0.586 3.956 1.00 0.00 H new ATOM 0 HA LEU A 90 10.068 0.487 4.208 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.350 -1.086 2.391 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.452 -2.330 3.237 1.00 0.00 H new ATOM 0 HG LEU A 90 9.049 -1.587 1.430 1.00 0.00 H new ATOM 0 HD11 LEU A 90 7.079 -0.633 2.593 1.00 0.00 H new ATOM 0 HD12 LEU A 90 7.844 -1.923 3.552 1.00 0.00 H new ATOM 0 HD13 LEU A 90 8.108 -0.217 3.984 1.00 0.00 H new ATOM 0 HD21 LEU A 90 8.449 0.808 1.087 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.524 1.264 2.430 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.204 0.551 0.948 1.00 0.00 H new ATOM 1439 N GLU A 91 10.687 -2.220 5.974 1.00 0.00 N ATOM 1440 CA GLU A 91 10.189 -3.036 7.067 1.00 0.00 C ATOM 1441 C GLU A 91 9.870 -2.171 8.279 1.00 0.00 C ATOM 1442 O GLU A 91 8.815 -2.315 8.895 1.00 0.00 O ATOM 1443 CB GLU A 91 11.242 -4.077 7.447 1.00 0.00 C ATOM 1444 CG GLU A 91 11.420 -5.072 6.298 1.00 0.00 C ATOM 1445 CD GLU A 91 12.566 -6.026 6.612 1.00 0.00 C ATOM 1446 OE1 GLU A 91 13.112 -5.925 7.699 1.00 0.00 O ATOM 1447 OE2 GLU A 91 12.886 -6.841 5.762 1.00 0.00 O ATOM 0 H GLU A 91 11.620 -2.471 5.647 1.00 0.00 H new ATOM 0 HA GLU A 91 9.276 -3.535 6.743 1.00 0.00 H new ATOM 0 HB2 GLU A 91 12.190 -3.586 7.666 1.00 0.00 H new ATOM 0 HB3 GLU A 91 10.938 -4.602 8.352 1.00 0.00 H new ATOM 0 HG2 GLU A 91 10.499 -5.634 6.146 1.00 0.00 H new ATOM 0 HG3 GLU A 91 11.624 -4.537 5.370 1.00 0.00 H new ATOM 1454 N ASN A 92 10.789 -1.274 8.612 1.00 0.00 N ATOM 1455 CA ASN A 92 10.598 -0.395 9.756 1.00 0.00 C ATOM 1456 C ASN A 92 9.391 0.512 9.544 1.00 0.00 C ATOM 1457 O ASN A 92 8.568 0.685 10.441 1.00 0.00 O ATOM 1458 CB ASN A 92 11.846 0.467 9.955 1.00 0.00 C ATOM 1459 CG ASN A 92 13.033 -0.406 10.347 1.00 0.00 C ATOM 1460 OD1 ASN A 92 14.109 -0.392 9.609 1.00 0.00 O flip ATOM 1461 ND2 ASN A 92 12.976 -1.121 11.347 1.00 0.00 N flip ATOM 0 H ASN A 92 11.667 -1.137 8.111 1.00 0.00 H new ATOM 0 HA ASN A 92 10.425 -1.011 10.639 1.00 0.00 H new ATOM 0 HB2 ASN A 92 12.072 1.010 9.037 1.00 0.00 H new ATOM 0 HB3 ASN A 92 11.662 1.212 10.729 1.00 0.00 H new ATOM 0 HD21 ASN A 92 12.133 -1.129 11.921 1.00 0.00 H new ATOM 0 HD22 ASN A 92 13.772 -1.706 11.602 1.00 0.00 H new ATOM 1468 N TYR A 93 9.295 1.093 8.353 1.00 0.00 N ATOM 1469 CA TYR A 93 8.188 1.989 8.041 1.00 0.00 C ATOM 1470 C TYR A 93 6.859 1.236 8.042 1.00 0.00 C ATOM 1471 O TYR A 93 5.865 1.715 8.587 1.00 0.00 O ATOM 1472 CB TYR A 93 8.414 2.644 6.675 1.00 0.00 C ATOM 1473 CG TYR A 93 7.492 3.835 6.526 1.00 0.00 C ATOM 1474 CD1 TYR A 93 7.692 4.967 7.322 1.00 0.00 C ATOM 1475 CD2 TYR A 93 6.446 3.813 5.592 1.00 0.00 C ATOM 1476 CE1 TYR A 93 6.849 6.076 7.192 1.00 0.00 C ATOM 1477 CE2 TYR A 93 5.602 4.924 5.462 1.00 0.00 C ATOM 1478 CZ TYR A 93 5.803 6.055 6.262 1.00 0.00 C ATOM 1479 OH TYR A 93 4.973 7.150 6.134 1.00 0.00 O ATOM 0 H TYR A 93 9.964 0.961 7.594 1.00 0.00 H new ATOM 0 HA TYR A 93 8.146 2.761 8.810 1.00 0.00 H new ATOM 0 HB2 TYR A 93 9.453 2.961 6.579 1.00 0.00 H new ATOM 0 HB3 TYR A 93 8.226 1.923 5.879 1.00 0.00 H new ATOM 0 HD1 TYR A 93 8.499 4.985 8.039 1.00 0.00 H new ATOM 0 HD2 TYR A 93 6.291 2.941 4.974 1.00 0.00 H new ATOM 0 HE1 TYR A 93 7.005 6.948 7.809 1.00 0.00 H new ATOM 0 HE2 TYR A 93 4.796 4.908 4.744 1.00 0.00 H new ATOM 0 HH TYR A 93 4.445 7.066 5.313 1.00 0.00 H new ATOM 1489 N ALA A 94 6.848 0.060 7.418 1.00 0.00 N ATOM 1490 CA ALA A 94 5.632 -0.747 7.344 1.00 0.00 C ATOM 1491 C ALA A 94 5.165 -1.147 8.740 1.00 0.00 C ATOM 1492 O ALA A 94 3.972 -1.096 9.046 1.00 0.00 O ATOM 1493 CB ALA A 94 5.899 -2.006 6.515 1.00 0.00 C ATOM 0 H ALA A 94 7.660 -0.353 6.960 1.00 0.00 H new ATOM 0 HA ALA A 94 4.850 -0.153 6.871 1.00 0.00 H new ATOM 0 HB1 ALA A 94 4.990 -2.606 6.462 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.205 -1.721 5.509 1.00 0.00 H new ATOM 0 HB3 ALA A 94 6.692 -2.589 6.984 1.00 0.00 H new ATOM 1499 N LEU A 95 6.115 -1.534 9.579 1.00 0.00 N ATOM 1500 CA LEU A 95 5.803 -1.930 10.946 1.00 0.00 C ATOM 1501 C LEU A 95 5.344 -0.731 11.763 1.00 0.00 C ATOM 1502 O LEU A 95 4.441 -0.842 12.592 1.00 0.00 O ATOM 1503 CB LEU A 95 7.032 -2.567 11.597 1.00 0.00 C ATOM 1504 CG LEU A 95 7.307 -3.929 10.946 1.00 0.00 C ATOM 1505 CD1 LEU A 95 8.711 -4.398 11.334 1.00 0.00 C ATOM 1506 CD2 LEU A 95 6.266 -4.977 11.403 1.00 0.00 C ATOM 0 H LEU A 95 7.105 -1.582 9.339 1.00 0.00 H new ATOM 0 HA LEU A 95 4.992 -2.658 10.919 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.898 -1.915 11.481 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.867 -2.690 12.667 1.00 0.00 H new ATOM 0 HG LEU A 95 7.235 -3.822 9.864 1.00 0.00 H new ATOM 0 HD11 LEU A 95 8.911 -5.366 10.874 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.446 -3.672 10.987 1.00 0.00 H new ATOM 0 HD13 LEU A 95 8.777 -4.491 12.418 1.00 0.00 H new ATOM 0 HD21 LEU A 95 6.481 -5.934 10.929 1.00 0.00 H new ATOM 0 HD22 LEU A 95 6.314 -5.090 12.486 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.267 -4.647 11.117 1.00 0.00 H new ATOM 1518 N LYS A 96 5.981 0.410 11.534 1.00 0.00 N ATOM 1519 CA LYS A 96 5.636 1.619 12.266 1.00 0.00 C ATOM 1520 C LYS A 96 4.191 2.025 11.995 1.00 0.00 C ATOM 1521 O LYS A 96 3.458 2.379 12.919 1.00 0.00 O ATOM 1522 CB LYS A 96 6.576 2.761 11.856 1.00 0.00 C ATOM 1523 CG LYS A 96 6.313 4.015 12.721 1.00 0.00 C ATOM 1524 CD LYS A 96 5.488 5.049 11.944 1.00 0.00 C ATOM 1525 CE LYS A 96 5.018 6.145 12.901 1.00 0.00 C ATOM 1526 NZ LYS A 96 4.446 7.265 12.111 1.00 0.00 N ATOM 0 H LYS A 96 6.732 0.523 10.853 1.00 0.00 H new ATOM 0 HA LYS A 96 5.746 1.418 13.332 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.613 2.445 11.969 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.429 3.001 10.803 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.784 3.731 13.631 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.261 4.456 13.028 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.088 5.482 11.144 1.00 0.00 H new ATOM 0 HD3 LYS A 96 4.630 4.568 11.475 1.00 0.00 H new ATOM 0 HE2 LYS A 96 4.271 5.749 13.589 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.852 6.499 13.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 4.723 8.170 12.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 4.805 7.221 11.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 3.409 7.189 12.101 1.00 0.00 H new ATOM 1540 N MET A 97 3.785 1.967 10.731 1.00 0.00 N ATOM 1541 CA MET A 97 2.422 2.333 10.368 1.00 0.00 C ATOM 1542 C MET A 97 1.423 1.356 10.979 1.00 0.00 C ATOM 1543 O MET A 97 0.401 1.762 11.537 1.00 0.00 O ATOM 1544 CB MET A 97 2.264 2.322 8.845 1.00 0.00 C ATOM 1545 CG MET A 97 0.950 3.007 8.439 1.00 0.00 C ATOM 1546 SD MET A 97 1.243 4.778 8.200 1.00 0.00 S ATOM 1547 CE MET A 97 1.501 4.727 6.408 1.00 0.00 C ATOM 0 H MET A 97 4.372 1.674 9.950 1.00 0.00 H new ATOM 0 HA MET A 97 2.225 3.334 10.752 1.00 0.00 H new ATOM 0 HB2 MET A 97 3.107 2.834 8.382 1.00 0.00 H new ATOM 0 HB3 MET A 97 2.275 1.295 8.479 1.00 0.00 H new ATOM 0 HG2 MET A 97 0.565 2.564 7.521 1.00 0.00 H new ATOM 0 HG3 MET A 97 0.194 2.853 9.209 1.00 0.00 H new ATOM 0 HE1 MET A 97 1.702 5.733 6.041 1.00 0.00 H new ATOM 0 HE2 MET A 97 2.350 4.082 6.181 1.00 0.00 H new ATOM 0 HE3 MET A 97 0.607 4.335 5.923 1.00 0.00 H new ATOM 1557 N PHE A 98 1.719 0.068 10.847 1.00 0.00 N ATOM 1558 CA PHE A 98 0.827 -0.963 11.365 1.00 0.00 C ATOM 1559 C PHE A 98 0.612 -0.759 12.857 1.00 0.00 C ATOM 1560 O PHE A 98 -0.519 -0.793 13.343 1.00 0.00 O ATOM 1561 CB PHE A 98 1.424 -2.352 11.122 1.00 0.00 C ATOM 1562 CG PHE A 98 0.377 -3.407 11.398 1.00 0.00 C ATOM 1563 CD1 PHE A 98 -0.679 -3.581 10.499 1.00 0.00 C ATOM 1564 CD2 PHE A 98 0.460 -4.213 12.544 1.00 0.00 C ATOM 1565 CE1 PHE A 98 -1.651 -4.559 10.737 1.00 0.00 C ATOM 1566 CE2 PHE A 98 -0.515 -5.192 12.782 1.00 0.00 C ATOM 1567 CZ PHE A 98 -1.570 -5.365 11.877 1.00 0.00 C ATOM 0 H PHE A 98 2.560 -0.285 10.391 1.00 0.00 H new ATOM 0 HA PHE A 98 -0.129 -0.890 10.846 1.00 0.00 H new ATOM 0 HB2 PHE A 98 1.775 -2.434 10.093 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.289 -2.506 11.767 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.745 -2.959 9.619 1.00 0.00 H new ATOM 0 HD2 PHE A 98 1.274 -4.079 13.241 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -2.465 -4.692 10.039 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -0.453 -5.813 13.663 1.00 0.00 H new ATOM 0 HZ PHE A 98 -2.320 -6.120 12.059 1.00 0.00 H new ATOM 1577 N LEU A 99 1.707 -0.566 13.587 1.00 0.00 N ATOM 1578 CA LEU A 99 1.625 -0.377 15.030 1.00 0.00 C ATOM 1579 C LEU A 99 0.764 0.836 15.364 1.00 0.00 C ATOM 1580 O LEU A 99 -0.044 0.794 16.290 1.00 0.00 O ATOM 1581 CB LEU A 99 3.048 -0.201 15.616 1.00 0.00 C ATOM 1582 CG LEU A 99 3.465 -1.447 16.421 1.00 0.00 C ATOM 1583 CD1 LEU A 99 2.546 -1.612 17.658 1.00 0.00 C ATOM 1584 CD2 LEU A 99 3.399 -2.698 15.513 1.00 0.00 C ATOM 0 H LEU A 99 2.653 -0.537 13.206 1.00 0.00 H new ATOM 0 HA LEU A 99 1.161 -1.258 15.474 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.760 -0.029 14.809 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.075 0.679 16.259 1.00 0.00 H new ATOM 0 HG LEU A 99 4.490 -1.327 16.773 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.848 -2.495 18.221 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.630 -0.731 18.294 1.00 0.00 H new ATOM 0 HD13 LEU A 99 1.513 -1.726 17.331 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.694 -3.578 16.084 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.381 -2.828 15.146 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.075 -2.570 14.668 1.00 0.00 H new ATOM 1596 N TYR A 100 0.945 1.912 14.617 1.00 0.00 N ATOM 1597 CA TYR A 100 0.179 3.119 14.865 1.00 0.00 C ATOM 1598 C TYR A 100 -1.315 2.804 14.829 1.00 0.00 C ATOM 1599 O TYR A 100 -2.056 3.168 15.742 1.00 0.00 O ATOM 1600 CB TYR A 100 0.523 4.155 13.793 1.00 0.00 C ATOM 1601 CG TYR A 100 -0.304 5.395 13.999 1.00 0.00 C ATOM 1602 CD1 TYR A 100 0.115 6.359 14.920 1.00 0.00 C ATOM 1603 CD2 TYR A 100 -1.486 5.577 13.276 1.00 0.00 C ATOM 1604 CE1 TYR A 100 -0.650 7.510 15.119 1.00 0.00 C ATOM 1605 CE2 TYR A 100 -2.253 6.731 13.473 1.00 0.00 C ATOM 1606 CZ TYR A 100 -1.833 7.697 14.396 1.00 0.00 C ATOM 1607 OH TYR A 100 -2.590 8.833 14.595 1.00 0.00 O ATOM 0 H TYR A 100 1.607 1.974 13.844 1.00 0.00 H new ATOM 0 HA TYR A 100 0.427 3.516 15.849 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.584 4.402 13.840 1.00 0.00 H new ATOM 0 HB3 TYR A 100 0.336 3.742 12.802 1.00 0.00 H new ATOM 0 HD1 TYR A 100 1.029 6.214 15.477 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -1.807 4.829 12.567 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -0.329 8.256 15.831 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -3.166 6.876 12.915 1.00 0.00 H new ATOM 0 HH TYR A 100 -3.425 8.594 15.049 1.00 0.00 H new ATOM 1617 N ALA A 101 -1.749 2.107 13.782 1.00 0.00 N ATOM 1618 CA ALA A 101 -3.156 1.740 13.657 1.00 0.00 C ATOM 1619 C ALA A 101 -3.544 0.690 14.697 1.00 0.00 C ATOM 1620 O ALA A 101 -4.595 0.786 15.330 1.00 0.00 O ATOM 1621 CB ALA A 101 -3.426 1.189 12.257 1.00 0.00 C ATOM 0 H ALA A 101 -1.155 1.788 13.017 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.755 2.635 13.825 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -4.478 0.917 12.170 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.185 1.949 11.514 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -2.808 0.307 12.087 1.00 0.00 H new ATOM 1627 N ASP A 102 -2.692 -0.312 14.859 1.00 0.00 N ATOM 1628 CA ASP A 102 -2.962 -1.382 15.815 1.00 0.00 C ATOM 1629 C ASP A 102 -3.086 -0.810 17.225 1.00 0.00 C ATOM 1630 O ASP A 102 -3.949 -1.224 17.999 1.00 0.00 O ATOM 1631 CB ASP A 102 -1.837 -2.417 15.781 1.00 0.00 C ATOM 1632 CG ASP A 102 -2.163 -3.582 16.710 1.00 0.00 C ATOM 1633 OD1 ASP A 102 -3.150 -3.488 17.422 1.00 0.00 O ATOM 1634 OD2 ASP A 102 -1.421 -4.550 16.696 1.00 0.00 O ATOM 0 H ASP A 102 -1.815 -0.409 14.347 1.00 0.00 H new ATOM 0 HA ASP A 102 -3.900 -1.863 15.539 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -1.700 -2.782 14.763 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -0.898 -1.954 16.083 1.00 0.00 H new ATOM 1639 N ASN A 103 -2.222 0.146 17.548 1.00 0.00 N ATOM 1640 CA ASN A 103 -2.248 0.770 18.863 1.00 0.00 C ATOM 1641 C ASN A 103 -3.569 1.500 19.081 1.00 0.00 C ATOM 1642 O ASN A 103 -4.180 1.393 20.145 1.00 0.00 O ATOM 1643 CB ASN A 103 -1.090 1.760 18.982 1.00 0.00 C ATOM 1644 CG ASN A 103 -1.164 2.496 20.310 1.00 0.00 C ATOM 1645 OD1 ASN A 103 -1.605 1.936 21.314 1.00 0.00 O ATOM 1646 ND2 ASN A 103 -0.754 3.732 20.370 1.00 0.00 N ATOM 0 H ASN A 103 -1.500 0.503 16.922 1.00 0.00 H new ATOM 0 HA ASN A 103 -2.147 -0.006 19.622 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -0.140 1.231 18.903 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -1.126 2.474 18.159 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -0.797 4.241 21.253 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -0.390 4.190 19.534 1.00 0.00 H new ATOM 1653 N GLU A 104 -4.011 2.231 18.062 1.00 0.00 N ATOM 1654 CA GLU A 104 -5.270 2.962 18.152 1.00 0.00 C ATOM 1655 C GLU A 104 -6.445 1.996 18.263 1.00 0.00 C ATOM 1656 O GLU A 104 -7.486 2.331 18.827 1.00 0.00 O ATOM 1657 CB GLU A 104 -5.447 3.862 16.924 1.00 0.00 C ATOM 1658 CG GLU A 104 -4.488 5.051 17.015 1.00 0.00 C ATOM 1659 CD GLU A 104 -4.596 5.905 15.757 1.00 0.00 C ATOM 1660 OE1 GLU A 104 -4.639 5.334 14.680 1.00 0.00 O ATOM 1661 OE2 GLU A 104 -4.639 7.118 15.888 1.00 0.00 O ATOM 0 H GLU A 104 -3.522 2.332 17.173 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.244 3.583 19.048 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -5.253 3.294 16.014 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.476 4.216 16.866 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -4.723 5.652 17.894 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -3.465 4.695 17.136 1.00 0.00 H new ATOM 1668 N ASP A 105 -6.276 0.800 17.711 1.00 0.00 N ATOM 1669 CA ASP A 105 -7.333 -0.206 17.745 1.00 0.00 C ATOM 1670 C ASP A 105 -7.547 -0.721 19.167 1.00 0.00 C ATOM 1671 O ASP A 105 -8.681 -0.874 19.620 1.00 0.00 O ATOM 1672 CB ASP A 105 -6.965 -1.370 16.817 1.00 0.00 C ATOM 1673 CG ASP A 105 -8.212 -2.160 16.434 1.00 0.00 C ATOM 1674 OD1 ASP A 105 -9.113 -2.243 17.251 1.00 0.00 O ATOM 1675 OD2 ASP A 105 -8.252 -2.662 15.322 1.00 0.00 O ATOM 0 H ASP A 105 -5.423 0.504 17.237 1.00 0.00 H new ATOM 0 HA ASP A 105 -8.261 0.252 17.404 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -6.479 -0.988 15.919 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -6.249 -2.026 17.312 1.00 0.00 H new ATOM 1680 N ARG A 106 -6.454 -0.985 19.871 1.00 0.00 N ATOM 1681 CA ARG A 106 -6.544 -1.481 21.239 1.00 0.00 C ATOM 1682 C ARG A 106 -7.187 -0.429 22.140 1.00 0.00 C ATOM 1683 O ARG A 106 -7.959 -0.754 23.043 1.00 0.00 O ATOM 1684 CB ARG A 106 -5.139 -1.824 21.748 1.00 0.00 C ATOM 1685 CG ARG A 106 -4.569 -3.021 20.963 1.00 0.00 C ATOM 1686 CD ARG A 106 -5.057 -4.345 21.567 1.00 0.00 C ATOM 1687 NE ARG A 106 -4.651 -5.469 20.726 1.00 0.00 N ATOM 1688 CZ ARG A 106 -5.365 -6.591 20.676 1.00 0.00 C ATOM 1689 NH1 ARG A 106 -6.450 -6.711 21.392 1.00 0.00 N ATOM 1690 NH2 ARG A 106 -4.978 -7.579 19.913 1.00 0.00 N ATOM 0 H ARG A 106 -5.503 -0.866 19.522 1.00 0.00 H new ATOM 0 HA ARG A 106 -7.164 -2.377 21.257 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -4.483 -0.961 21.637 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -5.177 -2.061 22.811 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -4.875 -2.957 19.919 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -3.480 -2.988 20.979 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -4.648 -4.467 22.570 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -6.142 -4.329 21.665 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.802 -5.392 20.165 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -6.753 -5.944 21.992 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -6.995 -7.572 21.352 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.128 -7.490 19.356 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -5.526 -8.439 19.875 1.00 0.00 H new ATOM 1704 N ALA A 107 -6.846 0.826 21.899 1.00 0.00 N ATOM 1705 CA ALA A 107 -7.377 1.913 22.708 1.00 0.00 C ATOM 1706 C ALA A 107 -8.894 1.988 22.563 1.00 0.00 C ATOM 1707 O ALA A 107 -9.557 2.718 23.298 1.00 0.00 O ATOM 1708 CB ALA A 107 -6.757 3.242 22.275 1.00 0.00 C ATOM 0 H ALA A 107 -6.210 1.117 21.157 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.127 1.722 23.751 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -7.161 4.049 22.887 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -5.675 3.197 22.402 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.992 3.429 21.227 1.00 0.00 H new ATOM 1714 N GLY A 108 -9.442 1.222 21.622 1.00 0.00 N ATOM 1715 CA GLY A 108 -10.886 1.209 21.410 1.00 0.00 C ATOM 1716 C GLY A 108 -11.325 2.407 20.577 1.00 0.00 C ATOM 1717 O GLY A 108 -12.420 2.938 20.760 1.00 0.00 O ATOM 0 H GLY A 108 -8.914 0.609 21.001 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -11.175 0.286 20.907 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -11.399 1.222 22.372 1.00 0.00 H new ATOM 1721 N ARG A 109 -10.458 2.819 19.656 1.00 0.00 N ATOM 1722 CA ARG A 109 -10.752 3.953 18.777 1.00 0.00 C ATOM 1723 C ARG A 109 -10.904 3.487 17.337 1.00 0.00 C ATOM 1724 O ARG A 109 -9.923 3.142 16.681 1.00 0.00 O ATOM 1725 CB ARG A 109 -9.628 4.987 18.863 1.00 0.00 C ATOM 1726 CG ARG A 109 -9.964 6.174 17.957 1.00 0.00 C ATOM 1727 CD ARG A 109 -8.976 7.313 18.211 1.00 0.00 C ATOM 1728 NE ARG A 109 -9.213 7.898 19.524 1.00 0.00 N ATOM 1729 CZ ARG A 109 -8.499 8.930 19.957 1.00 0.00 C ATOM 1730 NH1 ARG A 109 -7.563 9.438 19.205 1.00 0.00 N ATOM 1731 NH2 ARG A 109 -8.735 9.440 21.136 1.00 0.00 N ATOM 0 H ARG A 109 -9.548 2.387 19.497 1.00 0.00 H new ATOM 0 HA ARG A 109 -11.688 4.406 19.102 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.506 5.323 19.893 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.682 4.539 18.559 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -9.921 5.869 16.911 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -10.982 6.513 18.149 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.954 6.939 18.150 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -9.082 8.076 17.440 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.941 7.507 20.122 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -7.379 9.043 18.283 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -7.015 10.231 19.539 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -9.468 9.045 21.725 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -8.186 10.233 21.468 1.00 0.00 H new ATOM 1745 N PHE A 110 -12.144 3.473 16.849 1.00 0.00 N ATOM 1746 CA PHE A 110 -12.419 3.044 15.478 1.00 0.00 C ATOM 1747 C PHE A 110 -12.810 4.244 14.622 1.00 0.00 C ATOM 1748 O PHE A 110 -13.621 5.074 15.031 1.00 0.00 O ATOM 1749 CB PHE A 110 -13.549 2.012 15.476 1.00 0.00 C ATOM 1750 CG PHE A 110 -13.405 1.102 16.674 1.00 0.00 C ATOM 1751 CD1 PHE A 110 -12.360 0.174 16.727 1.00 0.00 C ATOM 1752 CD2 PHE A 110 -14.321 1.186 17.735 1.00 0.00 C ATOM 1753 CE1 PHE A 110 -12.225 -0.668 17.838 1.00 0.00 C ATOM 1754 CE2 PHE A 110 -14.185 0.344 18.845 1.00 0.00 C ATOM 1755 CZ PHE A 110 -13.138 -0.584 18.896 1.00 0.00 C ATOM 0 H PHE A 110 -12.970 3.752 17.379 1.00 0.00 H new ATOM 0 HA PHE A 110 -11.520 2.592 15.060 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -14.515 2.516 15.503 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -13.520 1.427 14.557 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -11.656 0.107 15.910 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -15.130 1.900 17.695 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -11.416 -1.382 17.879 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -14.888 0.410 19.662 1.00 0.00 H new ATOM 0 HZ PHE A 110 -13.035 -1.235 19.751 1.00 0.00 H new ATOM 1765 N HIS A 111 -12.225 4.327 13.432 1.00 0.00 N ATOM 1766 CA HIS A 111 -12.513 5.430 12.524 1.00 0.00 C ATOM 1767 C HIS A 111 -12.193 5.038 11.083 1.00 0.00 C ATOM 1768 O HIS A 111 -11.482 4.063 10.825 1.00 0.00 O ATOM 1769 CB HIS A 111 -11.693 6.669 12.931 1.00 0.00 C ATOM 1770 CG HIS A 111 -12.389 7.407 14.047 1.00 0.00 C ATOM 1771 ND1 HIS A 111 -13.761 7.600 14.063 1.00 0.00 N ATOM 1772 CD2 HIS A 111 -11.912 8.012 15.184 1.00 0.00 C ATOM 1773 CE1 HIS A 111 -14.061 8.296 15.176 1.00 0.00 C ATOM 1774 NE2 HIS A 111 -12.971 8.572 15.896 1.00 0.00 N ATOM 0 H HIS A 111 -11.553 3.648 13.076 1.00 0.00 H new ATOM 0 HA HIS A 111 -13.575 5.667 12.588 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -10.696 6.366 13.251 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -11.565 7.328 12.073 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -10.874 8.048 15.481 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -15.061 8.595 15.453 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -12.924 9.083 16.778 1.00 0.00 H new ATOM 1782 N LYS A 112 -12.725 5.815 10.149 1.00 0.00 N ATOM 1783 CA LYS A 112 -12.498 5.558 8.739 1.00 0.00 C ATOM 1784 C LYS A 112 -11.018 5.721 8.405 1.00 0.00 C ATOM 1785 O LYS A 112 -10.471 4.997 7.574 1.00 0.00 O ATOM 1786 CB LYS A 112 -13.330 6.518 7.881 1.00 0.00 C ATOM 1787 CG LYS A 112 -14.840 6.250 8.067 1.00 0.00 C ATOM 1788 CD LYS A 112 -15.370 6.972 9.323 1.00 0.00 C ATOM 1789 CE LYS A 112 -16.908 7.020 9.312 1.00 0.00 C ATOM 1790 NZ LYS A 112 -17.360 8.130 10.202 1.00 0.00 N ATOM 0 H LYS A 112 -13.314 6.625 10.344 1.00 0.00 H new ATOM 0 HA LYS A 112 -12.803 4.534 8.522 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -13.102 7.548 8.155 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -13.062 6.400 6.831 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -15.386 6.591 7.188 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -15.016 5.178 8.156 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -15.023 6.457 10.219 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -14.969 7.985 9.363 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -17.274 7.177 8.297 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -17.318 6.070 9.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -18.399 8.173 10.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -17.019 7.960 11.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -16.977 9.032 9.854 1.00 0.00 H new ATOM 1804 N ASN A 113 -10.380 6.685 9.054 1.00 0.00 N ATOM 1805 CA ASN A 113 -8.967 6.940 8.815 1.00 0.00 C ATOM 1806 C ASN A 113 -8.141 5.710 9.172 1.00 0.00 C ATOM 1807 O ASN A 113 -7.212 5.343 8.456 1.00 0.00 O ATOM 1808 CB ASN A 113 -8.509 8.128 9.660 1.00 0.00 C ATOM 1809 CG ASN A 113 -9.053 9.425 9.071 1.00 0.00 C ATOM 1810 OD1 ASN A 113 -9.187 9.547 7.854 1.00 0.00 O ATOM 1811 ND2 ASN A 113 -9.386 10.400 9.869 1.00 0.00 N ATOM 0 H ASN A 113 -10.814 7.298 9.744 1.00 0.00 H new ATOM 0 HA ASN A 113 -8.824 7.167 7.759 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -8.857 8.011 10.686 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -7.420 8.163 9.694 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -9.759 11.268 9.485 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -9.273 10.295 10.877 1.00 0.00 H new ATOM 1818 N MET A 114 -8.493 5.071 10.280 1.00 0.00 N ATOM 1819 CA MET A 114 -7.777 3.879 10.710 1.00 0.00 C ATOM 1820 C MET A 114 -7.929 2.772 9.673 1.00 0.00 C ATOM 1821 O MET A 114 -6.979 2.047 9.380 1.00 0.00 O ATOM 1822 CB MET A 114 -8.311 3.409 12.081 1.00 0.00 C ATOM 1823 CG MET A 114 -7.394 3.904 13.206 1.00 0.00 C ATOM 1824 SD MET A 114 -8.033 3.343 14.805 1.00 0.00 S ATOM 1825 CE MET A 114 -7.754 1.564 14.593 1.00 0.00 C ATOM 0 H MET A 114 -9.260 5.354 10.890 1.00 0.00 H new ATOM 0 HA MET A 114 -6.718 4.118 10.809 1.00 0.00 H new ATOM 0 HB2 MET A 114 -9.322 3.786 12.234 1.00 0.00 H new ATOM 0 HB3 MET A 114 -8.370 2.321 12.103 1.00 0.00 H new ATOM 0 HG2 MET A 114 -6.382 3.528 13.056 1.00 0.00 H new ATOM 0 HG3 MET A 114 -7.335 4.992 13.188 1.00 0.00 H new ATOM 0 HE1 MET A 114 -8.712 1.045 14.575 1.00 0.00 H new ATOM 0 HE2 MET A 114 -7.228 1.387 13.655 1.00 0.00 H new ATOM 0 HE3 MET A 114 -7.154 1.189 15.422 1.00 0.00 H new ATOM 1835 N ILE A 115 -9.124 2.641 9.120 1.00 0.00 N ATOM 1836 CA ILE A 115 -9.364 1.607 8.127 1.00 0.00 C ATOM 1837 C ILE A 115 -8.428 1.802 6.937 1.00 0.00 C ATOM 1838 O ILE A 115 -7.850 0.843 6.417 1.00 0.00 O ATOM 1839 CB ILE A 115 -10.823 1.663 7.656 1.00 0.00 C ATOM 1840 CG1 ILE A 115 -11.745 1.281 8.824 1.00 0.00 C ATOM 1841 CG2 ILE A 115 -11.023 0.682 6.499 1.00 0.00 C ATOM 1842 CD1 ILE A 115 -13.213 1.479 8.428 1.00 0.00 C ATOM 0 H ILE A 115 -9.930 3.227 9.337 1.00 0.00 H new ATOM 0 HA ILE A 115 -9.172 0.633 8.576 1.00 0.00 H new ATOM 0 HB ILE A 115 -11.063 2.671 7.317 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -11.574 0.242 9.107 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -11.511 1.891 9.696 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -12.059 0.721 6.164 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -10.364 0.953 5.674 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -10.788 -0.328 6.834 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -13.856 1.205 9.265 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -13.382 2.524 8.168 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -13.446 0.849 7.569 1.00 0.00 H new ATOM 1854 N LYS A 116 -8.272 3.049 6.518 1.00 0.00 N ATOM 1855 CA LYS A 116 -7.391 3.361 5.403 1.00 0.00 C ATOM 1856 C LYS A 116 -5.948 3.019 5.748 1.00 0.00 C ATOM 1857 O LYS A 116 -5.180 2.584 4.890 1.00 0.00 O ATOM 1858 CB LYS A 116 -7.513 4.843 5.032 1.00 0.00 C ATOM 1859 CG LYS A 116 -6.870 5.087 3.664 1.00 0.00 C ATOM 1860 CD LYS A 116 -7.088 6.540 3.249 1.00 0.00 C ATOM 1861 CE LYS A 116 -6.514 6.767 1.848 1.00 0.00 C ATOM 1862 NZ LYS A 116 -6.650 8.205 1.482 1.00 0.00 N ATOM 0 H LYS A 116 -8.740 3.856 6.930 1.00 0.00 H new ATOM 0 HA LYS A 116 -7.691 2.758 4.546 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -8.562 5.137 5.009 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -7.026 5.459 5.788 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -5.803 4.866 3.707 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -7.304 4.417 2.922 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -8.152 6.776 3.259 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -6.607 7.209 3.963 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -5.465 6.472 1.821 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -7.039 6.145 1.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -6.260 8.359 0.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -7.655 8.472 1.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -6.130 8.789 2.168 1.00 0.00 H new ATOM 1876 N SER A 117 -5.579 3.224 7.008 1.00 0.00 N ATOM 1877 CA SER A 117 -4.221 2.933 7.456 1.00 0.00 C ATOM 1878 C SER A 117 -3.894 1.452 7.269 1.00 0.00 C ATOM 1879 O SER A 117 -2.820 1.102 6.779 1.00 0.00 O ATOM 1880 CB SER A 117 -4.067 3.306 8.931 1.00 0.00 C ATOM 1881 OG SER A 117 -4.411 4.673 9.108 1.00 0.00 O ATOM 0 H SER A 117 -6.197 3.588 7.734 1.00 0.00 H new ATOM 0 HA SER A 117 -3.529 3.523 6.855 1.00 0.00 H new ATOM 0 HB2 SER A 117 -4.708 2.675 9.546 1.00 0.00 H new ATOM 0 HB3 SER A 117 -3.041 3.132 9.257 1.00 0.00 H new ATOM 0 HG SER A 117 -5.382 4.779 9.025 1.00 0.00 H new ATOM 1887 N PHE A 118 -4.829 0.586 7.659 1.00 0.00 N ATOM 1888 CA PHE A 118 -4.623 -0.856 7.524 1.00 0.00 C ATOM 1889 C PHE A 118 -4.447 -1.231 6.056 1.00 0.00 C ATOM 1890 O PHE A 118 -3.555 -2.005 5.700 1.00 0.00 O ATOM 1891 CB PHE A 118 -5.825 -1.618 8.120 1.00 0.00 C ATOM 1892 CG PHE A 118 -5.608 -1.865 9.597 1.00 0.00 C ATOM 1893 CD1 PHE A 118 -4.913 -3.006 10.012 1.00 0.00 C ATOM 1894 CD2 PHE A 118 -6.098 -0.961 10.545 1.00 0.00 C ATOM 1895 CE1 PHE A 118 -4.706 -3.244 11.375 1.00 0.00 C ATOM 1896 CE2 PHE A 118 -5.890 -1.197 11.909 1.00 0.00 C ATOM 1897 CZ PHE A 118 -5.193 -2.338 12.325 1.00 0.00 C ATOM 0 H PHE A 118 -5.725 0.853 8.066 1.00 0.00 H new ATOM 0 HA PHE A 118 -3.719 -1.132 8.067 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -6.739 -1.044 7.971 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -5.957 -2.567 7.601 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -4.536 -3.704 9.279 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -6.637 -0.081 10.225 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -4.171 -4.126 11.694 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -6.267 -0.498 12.641 1.00 0.00 H new ATOM 0 HZ PHE A 118 -5.031 -2.519 13.377 1.00 0.00 H new ATOM 1907 N TYR A 119 -5.295 -0.680 5.203 1.00 0.00 N ATOM 1908 CA TYR A 119 -5.210 -0.975 3.782 1.00 0.00 C ATOM 1909 C TYR A 119 -3.813 -0.622 3.269 1.00 0.00 C ATOM 1910 O TYR A 119 -3.174 -1.403 2.556 1.00 0.00 O ATOM 1911 CB TYR A 119 -6.260 -0.157 3.033 1.00 0.00 C ATOM 1912 CG TYR A 119 -6.321 -0.603 1.596 1.00 0.00 C ATOM 1913 CD1 TYR A 119 -7.093 -1.716 1.251 1.00 0.00 C ATOM 1914 CD2 TYR A 119 -5.621 0.100 0.608 1.00 0.00 C ATOM 1915 CE1 TYR A 119 -7.164 -2.132 -0.084 1.00 0.00 C ATOM 1916 CE2 TYR A 119 -5.691 -0.315 -0.726 1.00 0.00 C ATOM 1917 CZ TYR A 119 -6.462 -1.432 -1.071 1.00 0.00 C ATOM 1918 OH TYR A 119 -6.523 -1.847 -2.385 1.00 0.00 O ATOM 0 H TYR A 119 -6.040 -0.035 5.464 1.00 0.00 H new ATOM 0 HA TYR A 119 -5.393 -2.037 3.616 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -7.235 -0.281 3.504 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -6.013 0.904 3.085 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -7.635 -2.255 2.014 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -5.028 0.962 0.876 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -7.760 -2.992 -0.351 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -5.151 0.226 -1.489 1.00 0.00 H new ATOM 0 HH TYR A 119 -7.388 -2.276 -2.553 1.00 0.00 H new ATOM 1928 N THR A 120 -3.342 0.563 3.642 1.00 0.00 N ATOM 1929 CA THR A 120 -2.024 1.016 3.213 1.00 0.00 C ATOM 1930 C THR A 120 -0.957 0.019 3.651 1.00 0.00 C ATOM 1931 O THR A 120 -0.057 -0.313 2.882 1.00 0.00 O ATOM 1932 CB THR A 120 -1.720 2.391 3.822 1.00 0.00 C ATOM 1933 OG1 THR A 120 -2.858 3.230 3.685 1.00 0.00 O ATOM 1934 CG2 THR A 120 -0.539 3.026 3.084 1.00 0.00 C ATOM 0 H THR A 120 -3.847 1.222 4.235 1.00 0.00 H new ATOM 0 HA THR A 120 -2.018 1.092 2.126 1.00 0.00 H new ATOM 0 HB THR A 120 -1.474 2.273 4.877 1.00 0.00 H new ATOM 0 HG1 THR A 120 -3.492 3.042 4.408 1.00 0.00 H new ATOM 0 HG21 THR A 120 -0.323 4.003 3.516 1.00 0.00 H new ATOM 0 HG22 THR A 120 0.337 2.385 3.180 1.00 0.00 H new ATOM 0 HG23 THR A 120 -0.789 3.143 2.030 1.00 0.00 H new ATOM 1942 N ALA A 121 -1.061 -0.457 4.886 1.00 0.00 N ATOM 1943 CA ALA A 121 -0.090 -1.413 5.410 1.00 0.00 C ATOM 1944 C ALA A 121 0.011 -2.642 4.500 1.00 0.00 C ATOM 1945 O ALA A 121 1.105 -3.132 4.229 1.00 0.00 O ATOM 1946 CB ALA A 121 -0.500 -1.855 6.818 1.00 0.00 C ATOM 0 H ALA A 121 -1.801 -0.200 5.539 1.00 0.00 H new ATOM 0 HA ALA A 121 0.883 -0.924 5.448 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.229 -2.568 7.202 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -0.539 -0.986 7.475 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.482 -2.326 6.780 1.00 0.00 H new ATOM 1952 N SER A 122 -1.133 -3.136 4.036 1.00 0.00 N ATOM 1953 CA SER A 122 -1.147 -4.309 3.163 1.00 0.00 C ATOM 1954 C SER A 122 -0.361 -4.035 1.875 1.00 0.00 C ATOM 1955 O SER A 122 0.406 -4.885 1.402 1.00 0.00 O ATOM 1956 CB SER A 122 -2.590 -4.673 2.810 1.00 0.00 C ATOM 1957 OG SER A 122 -3.128 -3.669 1.961 1.00 0.00 O ATOM 0 H SER A 122 -2.053 -2.749 4.246 1.00 0.00 H new ATOM 0 HA SER A 122 -0.677 -5.138 3.692 1.00 0.00 H new ATOM 0 HB2 SER A 122 -2.622 -5.643 2.313 1.00 0.00 H new ATOM 0 HB3 SER A 122 -3.189 -4.759 3.717 1.00 0.00 H new ATOM 0 HG SER A 122 -3.094 -2.802 2.417 1.00 0.00 H new ATOM 1963 N LEU A 123 -0.552 -2.839 1.325 1.00 0.00 N ATOM 1964 CA LEU A 123 0.153 -2.464 0.095 1.00 0.00 C ATOM 1965 C LEU A 123 1.671 -2.459 0.320 1.00 0.00 C ATOM 1966 O LEU A 123 2.434 -2.947 -0.517 1.00 0.00 O ATOM 1967 CB LEU A 123 -0.319 -1.080 -0.393 1.00 0.00 C ATOM 1968 CG LEU A 123 -1.528 -1.224 -1.329 1.00 0.00 C ATOM 1969 CD1 LEU A 123 -2.702 -1.852 -0.581 1.00 0.00 C ATOM 1970 CD2 LEU A 123 -1.936 0.157 -1.838 1.00 0.00 C ATOM 0 H LEU A 123 -1.175 -2.123 1.699 1.00 0.00 H new ATOM 0 HA LEU A 123 -0.079 -3.204 -0.671 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -0.585 -0.458 0.461 1.00 0.00 H new ATOM 0 HB3 LEU A 123 0.494 -0.575 -0.914 1.00 0.00 H new ATOM 0 HG LEU A 123 -1.256 -1.866 -2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -3.553 -1.949 -1.255 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -2.415 -2.838 -0.215 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -2.977 -1.218 0.262 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -2.794 0.061 -2.503 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -2.201 0.792 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -1.104 0.605 -2.382 1.00 0.00 H new ATOM 1982 N LEU A 124 2.106 -1.928 1.455 1.00 0.00 N ATOM 1983 CA LEU A 124 3.532 -1.895 1.763 1.00 0.00 C ATOM 1984 C LEU A 124 4.091 -3.308 1.865 1.00 0.00 C ATOM 1985 O LEU A 124 5.194 -3.582 1.398 1.00 0.00 O ATOM 1986 CB LEU A 124 3.772 -1.131 3.076 1.00 0.00 C ATOM 1987 CG LEU A 124 4.052 0.353 2.797 1.00 0.00 C ATOM 1988 CD1 LEU A 124 2.853 1.014 2.130 1.00 0.00 C ATOM 1989 CD2 LEU A 124 4.334 1.061 4.119 1.00 0.00 C ATOM 0 H LEU A 124 1.503 -1.519 2.169 1.00 0.00 H new ATOM 0 HA LEU A 124 4.049 -1.378 0.955 1.00 0.00 H new ATOM 0 HB2 LEU A 124 2.900 -1.226 3.723 1.00 0.00 H new ATOM 0 HB3 LEU A 124 4.614 -1.571 3.610 1.00 0.00 H new ATOM 0 HG LEU A 124 4.911 0.428 2.130 1.00 0.00 H new ATOM 0 HD11 LEU A 124 3.075 2.065 1.942 1.00 0.00 H new ATOM 0 HD12 LEU A 124 2.640 0.513 1.185 1.00 0.00 H new ATOM 0 HD13 LEU A 124 1.985 0.938 2.785 1.00 0.00 H new ATOM 0 HD21 LEU A 124 4.534 2.116 3.931 1.00 0.00 H new ATOM 0 HD22 LEU A 124 3.468 0.967 4.774 1.00 0.00 H new ATOM 0 HD23 LEU A 124 5.202 0.607 4.597 1.00 0.00 H new ATOM 2001 N ILE A 125 3.342 -4.209 2.473 1.00 0.00 N ATOM 2002 CA ILE A 125 3.824 -5.567 2.602 1.00 0.00 C ATOM 2003 C ILE A 125 4.144 -6.129 1.222 1.00 0.00 C ATOM 2004 O ILE A 125 5.177 -6.767 1.023 1.00 0.00 O ATOM 2005 CB ILE A 125 2.766 -6.427 3.298 1.00 0.00 C ATOM 2006 CG1 ILE A 125 2.654 -5.998 4.770 1.00 0.00 C ATOM 2007 CG2 ILE A 125 3.154 -7.903 3.203 1.00 0.00 C ATOM 2008 CD1 ILE A 125 1.472 -6.709 5.446 1.00 0.00 C ATOM 0 H ILE A 125 2.422 -4.031 2.875 1.00 0.00 H new ATOM 0 HA ILE A 125 4.732 -5.576 3.204 1.00 0.00 H new ATOM 0 HB ILE A 125 1.801 -6.289 2.810 1.00 0.00 H new ATOM 0 HG12 ILE A 125 3.579 -6.235 5.296 1.00 0.00 H new ATOM 0 HG13 ILE A 125 2.521 -4.918 4.832 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.398 -8.511 3.700 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.223 -8.194 2.155 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.119 -8.057 3.686 1.00 0.00 H new ATOM 0 HD11 ILE A 125 1.406 -6.395 6.488 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.548 -6.450 4.929 1.00 0.00 H new ATOM 0 HD13 ILE A 125 1.622 -7.788 5.401 1.00 0.00 H new ATOM 2020 N ASP A 126 3.260 -5.886 0.268 1.00 0.00 N ATOM 2021 CA ASP A 126 3.473 -6.372 -1.090 1.00 0.00 C ATOM 2022 C ASP A 126 4.781 -5.808 -1.653 1.00 0.00 C ATOM 2023 O ASP A 126 5.569 -6.516 -2.312 1.00 0.00 O ATOM 2024 CB ASP A 126 2.306 -5.935 -1.973 1.00 0.00 C ATOM 2025 CG ASP A 126 0.978 -6.344 -1.336 1.00 0.00 C ATOM 2026 OD1 ASP A 126 0.915 -7.432 -0.789 1.00 0.00 O ATOM 2027 OD2 ASP A 126 0.047 -5.556 -1.401 1.00 0.00 O ATOM 0 H ASP A 126 2.396 -5.361 0.404 1.00 0.00 H new ATOM 0 HA ASP A 126 3.535 -7.460 -1.074 1.00 0.00 H new ATOM 0 HB2 ASP A 126 2.332 -4.854 -2.114 1.00 0.00 H new ATOM 0 HB3 ASP A 126 2.398 -6.388 -2.960 1.00 0.00 H new ATOM 2032 N VAL A 127 5.025 -4.536 -1.363 1.00 0.00 N ATOM 2033 CA VAL A 127 6.241 -3.894 -1.830 1.00 0.00 C ATOM 2034 C VAL A 127 7.448 -4.657 -1.310 1.00 0.00 C ATOM 2035 O VAL A 127 8.478 -4.713 -1.968 1.00 0.00 O ATOM 2036 CB VAL A 127 6.297 -2.433 -1.371 1.00 0.00 C ATOM 2037 CG1 VAL A 127 7.618 -1.806 -1.835 1.00 0.00 C ATOM 2038 CG2 VAL A 127 5.119 -1.665 -1.978 1.00 0.00 C ATOM 0 H VAL A 127 4.406 -3.939 -0.815 1.00 0.00 H new ATOM 0 HA VAL A 127 6.248 -3.904 -2.920 1.00 0.00 H new ATOM 0 HB VAL A 127 6.237 -2.386 -0.284 1.00 0.00 H new ATOM 0 HG11 VAL A 127 7.661 -0.766 -1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.454 -2.356 -1.403 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.679 -1.849 -2.922 1.00 0.00 H new ATOM 0 HG21 VAL A 127 5.156 -0.625 -1.653 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.178 -1.708 -3.066 1.00 0.00 H new ATOM 0 HG23 VAL A 127 4.183 -2.115 -1.648 1.00 0.00 H new ATOM 2048 N ILE A 128 7.321 -5.247 -0.125 1.00 0.00 N ATOM 2049 CA ILE A 128 8.419 -6.029 0.437 1.00 0.00 C ATOM 2050 C ILE A 128 8.572 -7.356 -0.307 1.00 0.00 C ATOM 2051 O ILE A 128 9.680 -7.779 -0.620 1.00 0.00 O ATOM 2052 CB ILE A 128 8.178 -6.302 1.920 1.00 0.00 C ATOM 2053 CG1 ILE A 128 7.979 -4.973 2.646 1.00 0.00 C ATOM 2054 CG2 ILE A 128 9.385 -7.036 2.520 1.00 0.00 C ATOM 2055 CD1 ILE A 128 7.602 -5.236 4.103 1.00 0.00 C ATOM 0 H ILE A 128 6.484 -5.201 0.457 1.00 0.00 H new ATOM 0 HA ILE A 128 9.336 -5.450 0.324 1.00 0.00 H new ATOM 0 HB ILE A 128 7.290 -6.924 2.034 1.00 0.00 H new ATOM 0 HG12 ILE A 128 8.893 -4.380 2.598 1.00 0.00 H new ATOM 0 HG13 ILE A 128 7.197 -4.393 2.156 1.00 0.00 H new ATOM 0 HG21 ILE A 128 9.206 -7.227 3.578 1.00 0.00 H new ATOM 0 HG22 ILE A 128 9.531 -7.983 2.000 1.00 0.00 H new ATOM 0 HG23 ILE A 128 10.277 -6.420 2.409 1.00 0.00 H new ATOM 0 HD11 ILE A 128 7.460 -4.287 4.619 1.00 0.00 H new ATOM 0 HD12 ILE A 128 6.677 -5.811 4.141 1.00 0.00 H new ATOM 0 HD13 ILE A 128 8.399 -5.798 4.589 1.00 0.00 H new ATOM 2067 N THR A 129 7.455 -8.030 -0.564 1.00 0.00 N ATOM 2068 CA THR A 129 7.504 -9.326 -1.232 1.00 0.00 C ATOM 2069 C THR A 129 8.368 -9.246 -2.471 1.00 0.00 C ATOM 2070 O THR A 129 9.059 -10.205 -2.820 1.00 0.00 O ATOM 2071 CB THR A 129 6.099 -9.778 -1.625 1.00 0.00 C ATOM 2072 OG1 THR A 129 5.535 -8.838 -2.526 1.00 0.00 O ATOM 2073 CG2 THR A 129 5.235 -9.874 -0.373 1.00 0.00 C ATOM 0 H THR A 129 6.518 -7.706 -0.324 1.00 0.00 H new ATOM 0 HA THR A 129 7.933 -10.050 -0.539 1.00 0.00 H new ATOM 0 HB THR A 129 6.147 -10.754 -2.109 1.00 0.00 H new ATOM 0 HG1 THR A 129 5.693 -7.930 -2.193 1.00 0.00 H new ATOM 0 HG21 THR A 129 4.231 -10.196 -0.648 1.00 0.00 H new ATOM 0 HG22 THR A 129 5.672 -10.597 0.316 1.00 0.00 H new ATOM 0 HG23 THR A 129 5.183 -8.898 0.109 1.00 0.00 H new ATOM 2081 N VAL A 130 8.327 -8.099 -3.135 1.00 0.00 N ATOM 2082 CA VAL A 130 9.132 -7.918 -4.344 1.00 0.00 C ATOM 2083 C VAL A 130 10.539 -8.498 -4.160 1.00 0.00 C ATOM 2084 O VAL A 130 11.128 -9.026 -5.104 1.00 0.00 O ATOM 2085 CB VAL A 130 9.256 -6.432 -4.687 1.00 0.00 C ATOM 2086 CG1 VAL A 130 7.871 -5.786 -4.650 1.00 0.00 C ATOM 2087 CG2 VAL A 130 10.205 -5.739 -3.689 1.00 0.00 C ATOM 0 H VAL A 130 7.760 -7.294 -2.869 1.00 0.00 H new ATOM 0 HA VAL A 130 8.628 -8.445 -5.154 1.00 0.00 H new ATOM 0 HB VAL A 130 9.671 -6.321 -5.689 1.00 0.00 H new ATOM 0 HG11 VAL A 130 7.957 -4.727 -4.894 1.00 0.00 H new ATOM 0 HG12 VAL A 130 7.222 -6.275 -5.377 1.00 0.00 H new ATOM 0 HG13 VAL A 130 7.445 -5.895 -3.653 1.00 0.00 H new ATOM 0 HG21 VAL A 130 10.288 -4.682 -3.940 1.00 0.00 H new ATOM 0 HG22 VAL A 130 9.809 -5.842 -2.679 1.00 0.00 H new ATOM 0 HG23 VAL A 130 11.190 -6.203 -3.742 1.00 0.00 H new ATOM 2097 N PHE A 131 11.072 -8.380 -2.942 1.00 0.00 N ATOM 2098 CA PHE A 131 12.413 -8.881 -2.646 1.00 0.00 C ATOM 2099 C PHE A 131 12.471 -10.393 -2.825 1.00 0.00 C ATOM 2100 O PHE A 131 13.436 -10.931 -3.369 1.00 0.00 O ATOM 2101 CB PHE A 131 12.814 -8.525 -1.203 1.00 0.00 C ATOM 2102 CG PHE A 131 13.013 -7.027 -1.074 1.00 0.00 C ATOM 2103 CD1 PHE A 131 14.019 -6.387 -1.811 1.00 0.00 C ATOM 2104 CD2 PHE A 131 12.181 -6.272 -0.233 1.00 0.00 C ATOM 2105 CE1 PHE A 131 14.193 -5.001 -1.706 1.00 0.00 C ATOM 2106 CE2 PHE A 131 12.352 -4.887 -0.133 1.00 0.00 C ATOM 2107 CZ PHE A 131 13.358 -4.251 -0.869 1.00 0.00 C ATOM 0 H PHE A 131 10.598 -7.945 -2.150 1.00 0.00 H new ATOM 0 HA PHE A 131 13.109 -8.410 -3.340 1.00 0.00 H new ATOM 0 HB2 PHE A 131 12.042 -8.859 -0.510 1.00 0.00 H new ATOM 0 HB3 PHE A 131 13.732 -9.047 -0.933 1.00 0.00 H new ATOM 0 HD1 PHE A 131 14.661 -6.963 -2.461 1.00 0.00 H new ATOM 0 HD2 PHE A 131 11.406 -6.762 0.339 1.00 0.00 H new ATOM 0 HE1 PHE A 131 14.972 -4.511 -2.271 1.00 0.00 H new ATOM 0 HE2 PHE A 131 11.707 -4.309 0.512 1.00 0.00 H new ATOM 0 HZ PHE A 131 13.490 -3.182 -0.791 1.00 0.00 H new ATOM 2117 N GLY A 132 11.425 -11.071 -2.363 1.00 0.00 N ATOM 2118 CA GLY A 132 11.344 -12.528 -2.468 1.00 0.00 C ATOM 2119 C GLY A 132 11.674 -13.200 -1.138 1.00 0.00 C ATOM 2120 O GLY A 132 11.356 -14.371 -0.934 1.00 0.00 O ATOM 0 H GLY A 132 10.620 -10.637 -1.912 1.00 0.00 H new ATOM 0 HA2 GLY A 132 10.342 -12.817 -2.785 1.00 0.00 H new ATOM 0 HA3 GLY A 132 12.034 -12.878 -3.236 1.00 0.00 H new ATOM 2124 N GLU A 133 12.316 -12.460 -0.234 1.00 0.00 N ATOM 2125 CA GLU A 133 12.686 -13.002 1.067 1.00 0.00 C ATOM 2126 C GLU A 133 11.717 -12.516 2.141 1.00 0.00 C ATOM 2127 O GLU A 133 12.092 -11.755 3.033 1.00 0.00 O ATOM 2128 CB GLU A 133 14.101 -12.556 1.418 1.00 0.00 C ATOM 2129 CG GLU A 133 14.570 -13.318 2.652 1.00 0.00 C ATOM 2130 CD GLU A 133 16.036 -13.016 2.929 1.00 0.00 C ATOM 2131 OE1 GLU A 133 16.687 -12.478 2.049 1.00 0.00 O ATOM 2132 OE2 GLU A 133 16.486 -13.330 4.018 1.00 0.00 O ATOM 0 H GLU A 133 12.588 -11.488 -0.381 1.00 0.00 H new ATOM 0 HA GLU A 133 12.643 -14.090 1.021 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.774 -12.744 0.581 1.00 0.00 H new ATOM 0 HB3 GLU A 133 14.121 -11.483 1.608 1.00 0.00 H new ATOM 0 HG2 GLU A 133 13.964 -13.038 3.514 1.00 0.00 H new ATOM 0 HG3 GLU A 133 14.434 -14.389 2.501 1.00 0.00 H new ATOM 2139 N LEU A 134 10.465 -12.949 2.043 1.00 0.00 N ATOM 2140 CA LEU A 134 9.446 -12.543 3.007 1.00 0.00 C ATOM 2141 C LEU A 134 9.338 -13.588 4.110 1.00 0.00 C ATOM 2142 O LEU A 134 9.102 -14.767 3.843 1.00 0.00 O ATOM 2143 CB LEU A 134 8.084 -12.397 2.305 1.00 0.00 C ATOM 2144 CG LEU A 134 7.133 -11.527 3.159 1.00 0.00 C ATOM 2145 CD1 LEU A 134 7.383 -10.033 2.872 1.00 0.00 C ATOM 2146 CD2 LEU A 134 5.659 -11.889 2.858 1.00 0.00 C ATOM 0 H LEU A 134 10.132 -13.577 1.312 1.00 0.00 H new ATOM 0 HA LEU A 134 9.731 -11.584 3.440 1.00 0.00 H new ATOM 0 HB2 LEU A 134 8.220 -11.944 1.323 1.00 0.00 H new ATOM 0 HB3 LEU A 134 7.643 -13.380 2.144 1.00 0.00 H new ATOM 0 HG LEU A 134 7.331 -11.722 4.213 1.00 0.00 H new ATOM 0 HD11 LEU A 134 6.708 -9.428 3.478 1.00 0.00 H new ATOM 0 HD12 LEU A 134 8.415 -9.783 3.118 1.00 0.00 H new ATOM 0 HD13 LEU A 134 7.203 -9.830 1.816 1.00 0.00 H new ATOM 0 HD21 LEU A 134 5.001 -11.269 3.466 1.00 0.00 H new ATOM 0 HD22 LEU A 134 5.450 -11.714 1.803 1.00 0.00 H new ATOM 0 HD23 LEU A 134 5.487 -12.939 3.093 1.00 0.00 H new ATOM 2158 N THR A 135 9.517 -13.151 5.348 1.00 0.00 N ATOM 2159 CA THR A 135 9.443 -14.058 6.485 1.00 0.00 C ATOM 2160 C THR A 135 7.988 -14.324 6.862 1.00 0.00 C ATOM 2161 O THR A 135 7.072 -13.622 6.419 1.00 0.00 O ATOM 2162 CB THR A 135 10.194 -13.451 7.676 1.00 0.00 C ATOM 2163 OG1 THR A 135 10.168 -14.367 8.761 1.00 0.00 O ATOM 2164 CG2 THR A 135 9.539 -12.131 8.112 1.00 0.00 C ATOM 0 H THR A 135 9.713 -12.180 5.591 1.00 0.00 H new ATOM 0 HA THR A 135 9.906 -15.006 6.212 1.00 0.00 H new ATOM 0 HB THR A 135 11.223 -13.251 7.378 1.00 0.00 H new ATOM 0 HG1 THR A 135 10.649 -13.984 9.524 1.00 0.00 H new ATOM 0 HG21 THR A 135 10.086 -11.716 8.958 1.00 0.00 H new ATOM 0 HG22 THR A 135 9.560 -11.423 7.283 1.00 0.00 H new ATOM 0 HG23 THR A 135 8.505 -12.317 8.404 1.00 0.00 H new ATOM 2172 N ASP A 136 7.777 -15.343 7.682 1.00 0.00 N ATOM 2173 CA ASP A 136 6.430 -15.697 8.103 1.00 0.00 C ATOM 2174 C ASP A 136 5.774 -14.518 8.810 1.00 0.00 C ATOM 2175 O ASP A 136 4.595 -14.239 8.600 1.00 0.00 O ATOM 2176 CB ASP A 136 6.479 -16.893 9.055 1.00 0.00 C ATOM 2177 CG ASP A 136 6.926 -18.143 8.304 1.00 0.00 C ATOM 2178 OD1 ASP A 136 6.320 -18.453 7.292 1.00 0.00 O ATOM 2179 OD2 ASP A 136 7.868 -18.774 8.757 1.00 0.00 O ATOM 0 H ASP A 136 8.514 -15.934 8.066 1.00 0.00 H new ATOM 0 HA ASP A 136 5.846 -15.958 7.220 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.167 -16.687 9.875 1.00 0.00 H new ATOM 0 HB3 ASP A 136 5.496 -17.057 9.497 1.00 0.00 H new ATOM 2184 N GLU A 137 6.535 -13.824 9.652 1.00 0.00 N ATOM 2185 CA GLU A 137 5.997 -12.685 10.376 1.00 0.00 C ATOM 2186 C GLU A 137 5.155 -11.811 9.447 1.00 0.00 C ATOM 2187 O GLU A 137 4.024 -11.449 9.774 1.00 0.00 O ATOM 2188 CB GLU A 137 7.159 -11.868 10.962 1.00 0.00 C ATOM 2189 CG GLU A 137 6.727 -11.206 12.264 1.00 0.00 C ATOM 2190 CD GLU A 137 6.583 -12.259 13.356 1.00 0.00 C ATOM 2191 OE1 GLU A 137 6.980 -13.388 13.118 1.00 0.00 O ATOM 2192 OE2 GLU A 137 6.075 -11.923 14.413 1.00 0.00 O ATOM 0 H GLU A 137 7.515 -14.030 9.846 1.00 0.00 H new ATOM 0 HA GLU A 137 5.356 -13.041 11.183 1.00 0.00 H new ATOM 0 HB2 GLU A 137 8.016 -12.517 11.142 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.478 -11.109 10.247 1.00 0.00 H new ATOM 0 HG2 GLU A 137 7.461 -10.457 12.563 1.00 0.00 H new ATOM 0 HG3 GLU A 137 5.780 -10.685 12.121 1.00 0.00 H new ATOM 2199 N ASN A 138 5.714 -11.475 8.287 1.00 0.00 N ATOM 2200 CA ASN A 138 5.005 -10.646 7.323 1.00 0.00 C ATOM 2201 C ASN A 138 3.779 -11.386 6.794 1.00 0.00 C ATOM 2202 O ASN A 138 2.719 -10.792 6.596 1.00 0.00 O ATOM 2203 CB ASN A 138 5.964 -10.276 6.161 1.00 0.00 C ATOM 2204 CG ASN A 138 6.195 -8.766 6.097 1.00 0.00 C ATOM 2205 OD1 ASN A 138 5.207 -7.976 5.787 1.00 0.00 O flip ATOM 2206 ND2 ASN A 138 7.309 -8.297 6.332 1.00 0.00 N flip ATOM 0 H ASN A 138 6.648 -11.763 7.996 1.00 0.00 H new ATOM 0 HA ASN A 138 4.666 -9.731 7.809 1.00 0.00 H new ATOM 0 HB2 ASN A 138 6.917 -10.787 6.295 1.00 0.00 H new ATOM 0 HB3 ASN A 138 5.546 -10.623 5.216 1.00 0.00 H new ATOM 0 HD21 ASN A 138 8.082 -8.916 6.575 1.00 0.00 H new ATOM 0 HD22 ASN A 138 7.459 -7.289 6.284 1.00 0.00 H new ATOM 2213 N VAL A 139 3.928 -12.682 6.559 1.00 0.00 N ATOM 2214 CA VAL A 139 2.818 -13.472 6.043 1.00 0.00 C ATOM 2215 C VAL A 139 1.641 -13.426 7.004 1.00 0.00 C ATOM 2216 O VAL A 139 0.495 -13.210 6.600 1.00 0.00 O ATOM 2217 CB VAL A 139 3.256 -14.924 5.849 1.00 0.00 C ATOM 2218 CG1 VAL A 139 2.070 -15.760 5.364 1.00 0.00 C ATOM 2219 CG2 VAL A 139 4.386 -14.982 4.822 1.00 0.00 C ATOM 0 H VAL A 139 4.791 -13.202 6.714 1.00 0.00 H new ATOM 0 HA VAL A 139 2.512 -13.052 5.085 1.00 0.00 H new ATOM 0 HB VAL A 139 3.611 -15.326 6.798 1.00 0.00 H new ATOM 0 HG11 VAL A 139 2.386 -16.794 5.227 1.00 0.00 H new ATOM 0 HG12 VAL A 139 1.270 -15.720 6.103 1.00 0.00 H new ATOM 0 HG13 VAL A 139 1.708 -15.362 4.416 1.00 0.00 H new ATOM 0 HG21 VAL A 139 4.699 -16.017 4.683 1.00 0.00 H new ATOM 0 HG22 VAL A 139 4.035 -14.578 3.872 1.00 0.00 H new ATOM 0 HG23 VAL A 139 5.231 -14.392 5.177 1.00 0.00 H new ATOM 2229 N LYS A 140 1.928 -13.621 8.282 1.00 0.00 N ATOM 2230 CA LYS A 140 0.880 -13.590 9.289 1.00 0.00 C ATOM 2231 C LYS A 140 0.244 -12.207 9.348 1.00 0.00 C ATOM 2232 O LYS A 140 -0.980 -12.079 9.390 1.00 0.00 O ATOM 2233 CB LYS A 140 1.470 -13.950 10.662 1.00 0.00 C ATOM 2234 CG LYS A 140 0.356 -14.316 11.678 1.00 0.00 C ATOM 2235 CD LYS A 140 0.128 -13.166 12.677 1.00 0.00 C ATOM 2236 CE LYS A 140 1.238 -13.149 13.736 1.00 0.00 C ATOM 2237 NZ LYS A 140 0.866 -12.197 14.820 1.00 0.00 N ATOM 0 H LYS A 140 2.865 -13.800 8.643 1.00 0.00 H new ATOM 0 HA LYS A 140 0.113 -14.318 9.022 1.00 0.00 H new ATOM 0 HB2 LYS A 140 2.158 -14.789 10.556 1.00 0.00 H new ATOM 0 HB3 LYS A 140 2.050 -13.109 11.043 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -0.571 -14.531 11.146 1.00 0.00 H new ATOM 0 HG3 LYS A 140 0.632 -15.222 12.217 1.00 0.00 H new ATOM 0 HD2 LYS A 140 0.108 -12.214 12.147 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -0.842 -13.282 13.160 1.00 0.00 H new ATOM 0 HE2 LYS A 140 1.381 -14.149 14.147 1.00 0.00 H new ATOM 0 HE3 LYS A 140 2.184 -12.852 13.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 1.615 -12.182 15.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 0.750 -11.244 14.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -0.028 -12.500 15.257 1.00 0.00 H new ATOM 2251 N HIS A 141 1.082 -11.174 9.340 1.00 0.00 N ATOM 2252 CA HIS A 141 0.580 -9.809 9.385 1.00 0.00 C ATOM 2253 C HIS A 141 -0.279 -9.526 8.163 1.00 0.00 C ATOM 2254 O HIS A 141 -1.328 -8.898 8.268 1.00 0.00 O ATOM 2255 CB HIS A 141 1.750 -8.814 9.448 1.00 0.00 C ATOM 2256 CG HIS A 141 2.317 -8.765 10.849 1.00 0.00 C ATOM 2257 ND1 HIS A 141 3.371 -7.926 11.181 1.00 0.00 N ATOM 2258 CD2 HIS A 141 1.992 -9.431 12.009 1.00 0.00 C ATOM 2259 CE1 HIS A 141 3.639 -8.104 12.488 1.00 0.00 C ATOM 2260 NE2 HIS A 141 2.827 -9.008 13.040 1.00 0.00 N ATOM 0 H HIS A 141 2.098 -11.256 9.303 1.00 0.00 H new ATOM 0 HA HIS A 141 -0.030 -9.691 10.280 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.527 -9.110 8.743 1.00 0.00 H new ATOM 0 HB3 HIS A 141 1.410 -7.822 9.150 1.00 0.00 H new ATOM 0 HD2 HIS A 141 1.209 -10.169 12.105 1.00 0.00 H new ATOM 0 HE1 HIS A 141 4.416 -7.580 13.024 1.00 0.00 H new ATOM 0 HE2 HIS A 141 2.820 -9.322 14.010 1.00 0.00 H new ATOM 2268 N ARG A 142 0.169 -9.983 7.005 1.00 0.00 N ATOM 2269 CA ARG A 142 -0.578 -9.759 5.777 1.00 0.00 C ATOM 2270 C ARG A 142 -2.023 -10.208 5.953 1.00 0.00 C ATOM 2271 O ARG A 142 -2.956 -9.450 5.678 1.00 0.00 O ATOM 2272 CB ARG A 142 0.069 -10.555 4.633 1.00 0.00 C ATOM 2273 CG ARG A 142 -0.811 -10.499 3.370 1.00 0.00 C ATOM 2274 CD ARG A 142 -0.120 -11.223 2.204 1.00 0.00 C ATOM 2275 NE ARG A 142 0.721 -10.300 1.458 1.00 0.00 N ATOM 2276 CZ ARG A 142 1.186 -10.627 0.262 1.00 0.00 C ATOM 2277 NH1 ARG A 142 0.911 -11.798 -0.242 1.00 0.00 N ATOM 2278 NH2 ARG A 142 1.910 -9.778 -0.411 1.00 0.00 N ATOM 0 H ARG A 142 1.037 -10.506 6.889 1.00 0.00 H new ATOM 0 HA ARG A 142 -0.563 -8.695 5.540 1.00 0.00 H new ATOM 0 HB2 ARG A 142 1.057 -10.149 4.413 1.00 0.00 H new ATOM 0 HB3 ARG A 142 0.211 -11.592 4.939 1.00 0.00 H new ATOM 0 HG2 ARG A 142 -1.778 -10.961 3.572 1.00 0.00 H new ATOM 0 HG3 ARG A 142 -1.004 -9.461 3.099 1.00 0.00 H new ATOM 0 HD2 ARG A 142 0.483 -12.046 2.586 1.00 0.00 H new ATOM 0 HD3 ARG A 142 -0.870 -11.657 1.542 1.00 0.00 H new ATOM 0 HE ARG A 142 0.955 -9.392 1.860 1.00 0.00 H new ATOM 0 HH11 ARG A 142 0.339 -12.458 0.285 1.00 0.00 H new ATOM 0 HH12 ARG A 142 1.267 -12.053 -1.163 1.00 0.00 H new ATOM 0 HH21 ARG A 142 2.119 -8.861 -0.017 1.00 0.00 H new ATOM 0 HH22 ARG A 142 2.268 -10.031 -1.332 1.00 0.00 H new ATOM 2292 N LYS A 143 -2.200 -11.442 6.405 1.00 0.00 N ATOM 2293 CA LYS A 143 -3.538 -11.988 6.600 1.00 0.00 C ATOM 2294 C LYS A 143 -4.268 -11.279 7.733 1.00 0.00 C ATOM 2295 O LYS A 143 -5.480 -11.075 7.674 1.00 0.00 O ATOM 2296 CB LYS A 143 -3.460 -13.489 6.895 1.00 0.00 C ATOM 2297 CG LYS A 143 -3.035 -14.262 5.635 1.00 0.00 C ATOM 2298 CD LYS A 143 -4.247 -14.510 4.723 1.00 0.00 C ATOM 2299 CE LYS A 143 -3.821 -15.365 3.526 1.00 0.00 C ATOM 2300 NZ LYS A 143 -3.060 -14.520 2.563 1.00 0.00 N ATOM 0 H LYS A 143 -1.441 -12.081 6.642 1.00 0.00 H new ATOM 0 HA LYS A 143 -4.099 -11.827 5.679 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -2.747 -13.671 7.699 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -4.429 -13.849 7.241 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -2.275 -13.698 5.094 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -2.585 -15.213 5.919 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -5.037 -15.014 5.280 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -4.656 -13.560 4.378 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -3.205 -16.199 3.861 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -4.698 -15.792 3.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -2.857 -15.070 1.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -3.625 -13.683 2.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -2.166 -14.216 2.999 1.00 0.00 H new ATOM 2314 N TYR A 144 -3.526 -10.906 8.763 1.00 0.00 N ATOM 2315 CA TYR A 144 -4.118 -10.222 9.900 1.00 0.00 C ATOM 2316 C TYR A 144 -4.530 -8.798 9.524 1.00 0.00 C ATOM 2317 O TYR A 144 -5.591 -8.321 9.931 1.00 0.00 O ATOM 2318 CB TYR A 144 -3.117 -10.199 11.061 1.00 0.00 C ATOM 2319 CG TYR A 144 -3.856 -10.047 12.369 1.00 0.00 C ATOM 2320 CD1 TYR A 144 -4.316 -8.790 12.776 1.00 0.00 C ATOM 2321 CD2 TYR A 144 -4.095 -11.174 13.166 1.00 0.00 C ATOM 2322 CE1 TYR A 144 -5.011 -8.659 13.984 1.00 0.00 C ATOM 2323 CE2 TYR A 144 -4.791 -11.042 14.370 1.00 0.00 C ATOM 2324 CZ TYR A 144 -5.249 -9.786 14.780 1.00 0.00 C ATOM 2325 OH TYR A 144 -5.936 -9.657 15.969 1.00 0.00 O ATOM 0 H TYR A 144 -2.521 -11.064 8.835 1.00 0.00 H new ATOM 0 HA TYR A 144 -5.014 -10.761 10.207 1.00 0.00 H new ATOM 0 HB2 TYR A 144 -2.532 -11.119 11.068 1.00 0.00 H new ATOM 0 HB3 TYR A 144 -2.415 -9.376 10.932 1.00 0.00 H new ATOM 0 HD1 TYR A 144 -4.135 -7.922 12.159 1.00 0.00 H new ATOM 0 HD2 TYR A 144 -3.741 -12.144 12.850 1.00 0.00 H new ATOM 0 HE1 TYR A 144 -5.364 -7.689 14.302 1.00 0.00 H new ATOM 0 HE2 TYR A 144 -4.975 -11.911 14.985 1.00 0.00 H new ATOM 0 HH TYR A 144 -6.016 -10.535 16.398 1.00 0.00 H new ATOM 2335 N ALA A 145 -3.674 -8.125 8.760 1.00 0.00 N ATOM 2336 CA ALA A 145 -3.938 -6.749 8.342 1.00 0.00 C ATOM 2337 C ALA A 145 -5.193 -6.671 7.487 1.00 0.00 C ATOM 2338 O ALA A 145 -6.063 -5.832 7.719 1.00 0.00 O ATOM 2339 CB ALA A 145 -2.748 -6.203 7.548 1.00 0.00 C ATOM 0 H ALA A 145 -2.793 -8.508 8.418 1.00 0.00 H new ATOM 0 HA ALA A 145 -4.087 -6.148 9.239 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -2.955 -5.178 7.241 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -1.855 -6.222 8.172 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -2.586 -6.820 6.664 1.00 0.00 H new ATOM 2345 N ARG A 146 -5.291 -7.558 6.506 1.00 0.00 N ATOM 2346 CA ARG A 146 -6.456 -7.579 5.638 1.00 0.00 C ATOM 2347 C ARG A 146 -7.693 -7.996 6.415 1.00 0.00 C ATOM 2348 O ARG A 146 -8.773 -7.442 6.224 1.00 0.00 O ATOM 2349 CB ARG A 146 -6.232 -8.535 4.467 1.00 0.00 C ATOM 2350 CG ARG A 146 -5.233 -7.919 3.487 1.00 0.00 C ATOM 2351 CD ARG A 146 -4.988 -8.888 2.330 1.00 0.00 C ATOM 2352 NE ARG A 146 -4.115 -8.275 1.337 1.00 0.00 N ATOM 2353 CZ ARG A 146 -3.498 -9.009 0.417 1.00 0.00 C ATOM 2354 NH1 ARG A 146 -3.657 -10.304 0.405 1.00 0.00 N ATOM 2355 NH2 ARG A 146 -2.734 -8.436 -0.472 1.00 0.00 N ATOM 0 H ARG A 146 -4.586 -8.264 6.294 1.00 0.00 H new ATOM 0 HA ARG A 146 -6.608 -6.572 5.249 1.00 0.00 H new ATOM 0 HB2 ARG A 146 -5.857 -9.491 4.832 1.00 0.00 H new ATOM 0 HB3 ARG A 146 -7.177 -8.735 3.962 1.00 0.00 H new ATOM 0 HG2 ARG A 146 -5.617 -6.972 3.107 1.00 0.00 H new ATOM 0 HG3 ARG A 146 -4.295 -7.701 3.997 1.00 0.00 H new ATOM 0 HD2 ARG A 146 -4.536 -9.807 2.705 1.00 0.00 H new ATOM 0 HD3 ARG A 146 -5.937 -9.164 1.870 1.00 0.00 H new ATOM 0 HE ARG A 146 -3.975 -7.265 1.348 1.00 0.00 H new ATOM 0 HH11 ARG A 146 -4.254 -10.751 1.101 1.00 0.00 H new ATOM 0 HH12 ARG A 146 -3.184 -10.869 -0.300 1.00 0.00 H new ATOM 0 HH21 ARG A 146 -2.610 -7.424 -0.461 1.00 0.00 H new ATOM 0 HH22 ARG A 146 -2.261 -9.000 -1.178 1.00 0.00 H new ATOM 2369 N TRP A 147 -7.534 -8.980 7.293 1.00 0.00 N ATOM 2370 CA TRP A 147 -8.660 -9.455 8.085 1.00 0.00 C ATOM 2371 C TRP A 147 -9.272 -8.300 8.872 1.00 0.00 C ATOM 2372 O TRP A 147 -10.480 -8.080 8.825 1.00 0.00 O ATOM 2373 CB TRP A 147 -8.195 -10.559 9.043 1.00 0.00 C ATOM 2374 CG TRP A 147 -9.278 -10.875 10.027 1.00 0.00 C ATOM 2375 CD1 TRP A 147 -10.589 -11.020 9.724 1.00 0.00 C ATOM 2376 CD2 TRP A 147 -9.165 -11.090 11.465 1.00 0.00 C ATOM 2377 NE1 TRP A 147 -11.288 -11.302 10.886 1.00 0.00 N ATOM 2378 CE2 TRP A 147 -10.454 -11.358 11.983 1.00 0.00 C ATOM 2379 CE3 TRP A 147 -8.080 -11.080 12.360 1.00 0.00 C ATOM 2380 CZ2 TRP A 147 -10.661 -11.602 13.340 1.00 0.00 C ATOM 2381 CZ3 TRP A 147 -8.286 -11.326 13.728 1.00 0.00 C ATOM 2382 CH2 TRP A 147 -9.573 -11.588 14.216 1.00 0.00 C ATOM 0 H TRP A 147 -6.651 -9.457 7.472 1.00 0.00 H new ATOM 0 HA TRP A 147 -9.418 -9.863 7.416 1.00 0.00 H new ATOM 0 HB2 TRP A 147 -7.933 -11.454 8.479 1.00 0.00 H new ATOM 0 HB3 TRP A 147 -7.296 -10.239 9.570 1.00 0.00 H new ATOM 0 HD1 TRP A 147 -11.020 -10.930 8.738 1.00 0.00 H new ATOM 0 HE1 TRP A 147 -12.296 -11.450 10.926 1.00 0.00 H new ATOM 0 HE3 TRP A 147 -7.083 -10.882 11.994 1.00 0.00 H new ATOM 0 HZ2 TRP A 147 -11.656 -11.800 13.711 1.00 0.00 H new ATOM 0 HZ3 TRP A 147 -7.447 -11.313 14.408 1.00 0.00 H new ATOM 0 HH2 TRP A 147 -9.724 -11.779 15.268 1.00 0.00 H new ATOM 2393 N LYS A 148 -8.425 -7.568 9.590 1.00 0.00 N ATOM 2394 CA LYS A 148 -8.892 -6.436 10.384 1.00 0.00 C ATOM 2395 C LYS A 148 -9.560 -5.395 9.488 1.00 0.00 C ATOM 2396 O LYS A 148 -10.606 -4.842 9.833 1.00 0.00 O ATOM 2397 CB LYS A 148 -7.698 -5.809 11.151 1.00 0.00 C ATOM 2398 CG LYS A 148 -7.801 -6.085 12.661 1.00 0.00 C ATOM 2399 CD LYS A 148 -8.822 -5.125 13.283 1.00 0.00 C ATOM 2400 CE LYS A 148 -8.850 -5.318 14.798 1.00 0.00 C ATOM 2401 NZ LYS A 148 -7.516 -4.966 15.355 1.00 0.00 N ATOM 0 H LYS A 148 -7.420 -7.736 9.639 1.00 0.00 H new ATOM 0 HA LYS A 148 -9.631 -6.787 11.105 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -6.762 -6.215 10.767 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -7.674 -4.733 10.976 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -8.104 -7.118 12.834 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -6.827 -5.955 13.133 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -8.561 -4.094 13.042 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -9.811 -5.309 12.864 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -9.622 -4.690 15.243 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -9.099 -6.351 15.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -7.545 -5.029 16.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -6.801 -5.626 14.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -7.268 -3.996 15.074 1.00 0.00 H new ATOM 2415 N ALA A 149 -8.955 -5.131 8.340 1.00 0.00 N ATOM 2416 CA ALA A 149 -9.507 -4.156 7.416 1.00 0.00 C ATOM 2417 C ALA A 149 -10.922 -4.550 7.016 1.00 0.00 C ATOM 2418 O ALA A 149 -11.842 -3.730 7.047 1.00 0.00 O ATOM 2419 CB ALA A 149 -8.621 -4.062 6.174 1.00 0.00 C ATOM 0 H ALA A 149 -8.090 -5.574 8.029 1.00 0.00 H new ATOM 0 HA ALA A 149 -9.541 -3.184 7.907 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -9.039 -3.329 5.484 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -7.617 -3.754 6.466 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -8.574 -5.035 5.686 1.00 0.00 H new ATOM 2425 N THR A 150 -11.099 -5.811 6.648 1.00 0.00 N ATOM 2426 CA THR A 150 -12.412 -6.288 6.248 1.00 0.00 C ATOM 2427 C THR A 150 -13.336 -6.428 7.449 1.00 0.00 C ATOM 2428 O THR A 150 -14.498 -6.042 7.387 1.00 0.00 O ATOM 2429 CB THR A 150 -12.281 -7.639 5.547 1.00 0.00 C ATOM 2430 OG1 THR A 150 -11.693 -8.573 6.440 1.00 0.00 O ATOM 2431 CG2 THR A 150 -11.394 -7.505 4.303 1.00 0.00 C ATOM 0 H THR A 150 -10.360 -6.513 6.618 1.00 0.00 H new ATOM 0 HA THR A 150 -12.843 -5.557 5.565 1.00 0.00 H new ATOM 0 HB THR A 150 -13.271 -7.982 5.245 1.00 0.00 H new ATOM 0 HG1 THR A 150 -10.721 -8.452 6.446 1.00 0.00 H new ATOM 0 HG21 THR A 150 -11.308 -8.474 3.812 1.00 0.00 H new ATOM 0 HG22 THR A 150 -11.839 -6.787 3.614 1.00 0.00 H new ATOM 0 HG23 THR A 150 -10.404 -7.158 4.598 1.00 0.00 H new ATOM 2439 N TYR A 151 -12.828 -7.004 8.532 1.00 0.00 N ATOM 2440 CA TYR A 151 -13.639 -7.213 9.722 1.00 0.00 C ATOM 2441 C TYR A 151 -14.345 -5.921 10.113 1.00 0.00 C ATOM 2442 O TYR A 151 -15.564 -5.899 10.292 1.00 0.00 O ATOM 2443 CB TYR A 151 -12.734 -7.669 10.870 1.00 0.00 C ATOM 2444 CG TYR A 151 -13.573 -8.227 11.992 1.00 0.00 C ATOM 2445 CD1 TYR A 151 -14.268 -9.425 11.800 1.00 0.00 C ATOM 2446 CD2 TYR A 151 -13.652 -7.561 13.221 1.00 0.00 C ATOM 2447 CE1 TYR A 151 -15.044 -9.958 12.832 1.00 0.00 C ATOM 2448 CE2 TYR A 151 -14.431 -8.094 14.256 1.00 0.00 C ATOM 2449 CZ TYR A 151 -15.125 -9.294 14.061 1.00 0.00 C ATOM 2450 OH TYR A 151 -15.892 -9.823 15.078 1.00 0.00 O ATOM 0 H TYR A 151 -11.865 -7.332 8.610 1.00 0.00 H new ATOM 0 HA TYR A 151 -14.391 -7.975 9.515 1.00 0.00 H new ATOM 0 HB2 TYR A 151 -12.035 -8.426 10.515 1.00 0.00 H new ATOM 0 HB3 TYR A 151 -12.139 -6.830 11.231 1.00 0.00 H new ATOM 0 HD1 TYR A 151 -14.205 -9.939 10.852 1.00 0.00 H new ATOM 0 HD2 TYR A 151 -13.113 -6.637 13.371 1.00 0.00 H new ATOM 0 HE1 TYR A 151 -15.581 -10.883 12.681 1.00 0.00 H new ATOM 0 HE2 TYR A 151 -14.496 -7.580 15.203 1.00 0.00 H new ATOM 0 HH TYR A 151 -15.911 -10.800 14.999 1.00 0.00 H new ATOM 2460 N ILE A 152 -13.574 -4.852 10.234 1.00 0.00 N ATOM 2461 CA ILE A 152 -14.130 -3.554 10.597 1.00 0.00 C ATOM 2462 C ILE A 152 -15.099 -3.076 9.517 1.00 0.00 C ATOM 2463 O ILE A 152 -16.176 -2.565 9.815 1.00 0.00 O ATOM 2464 CB ILE A 152 -13.005 -2.529 10.771 1.00 0.00 C ATOM 2465 CG1 ILE A 152 -12.147 -2.909 11.985 1.00 0.00 C ATOM 2466 CG2 ILE A 152 -13.610 -1.138 10.999 1.00 0.00 C ATOM 2467 CD1 ILE A 152 -10.825 -2.131 11.951 1.00 0.00 C ATOM 0 H ILE A 152 -12.565 -4.855 10.087 1.00 0.00 H new ATOM 0 HA ILE A 152 -14.669 -3.657 11.539 1.00 0.00 H new ATOM 0 HB ILE A 152 -12.386 -2.518 9.874 1.00 0.00 H new ATOM 0 HG12 ILE A 152 -12.686 -2.688 12.906 1.00 0.00 H new ATOM 0 HG13 ILE A 152 -11.949 -3.981 11.981 1.00 0.00 H new ATOM 0 HG21 ILE A 152 -12.809 -0.409 11.123 1.00 0.00 H new ATOM 0 HG22 ILE A 152 -14.222 -0.862 10.140 1.00 0.00 H new ATOM 0 HG23 ILE A 152 -14.229 -1.153 11.896 1.00 0.00 H new ATOM 0 HD11 ILE A 152 -10.220 -2.404 12.815 1.00 0.00 H new ATOM 0 HD12 ILE A 152 -10.283 -2.374 11.037 1.00 0.00 H new ATOM 0 HD13 ILE A 152 -11.032 -1.061 11.977 1.00 0.00 H new ATOM 2479 N HIS A 153 -14.704 -3.245 8.263 1.00 0.00 N ATOM 2480 CA HIS A 153 -15.539 -2.823 7.147 1.00 0.00 C ATOM 2481 C HIS A 153 -16.855 -3.601 7.123 1.00 0.00 C ATOM 2482 O HIS A 153 -17.927 -3.029 6.912 1.00 0.00 O ATOM 2483 CB HIS A 153 -14.789 -3.050 5.837 1.00 0.00 C ATOM 2484 CG HIS A 153 -15.591 -2.496 4.695 1.00 0.00 C ATOM 2485 ND1 HIS A 153 -15.866 -1.145 4.572 1.00 0.00 N ATOM 2486 CD2 HIS A 153 -16.186 -3.101 3.618 1.00 0.00 C ATOM 2487 CE1 HIS A 153 -16.599 -0.983 3.457 1.00 0.00 C ATOM 2488 NE2 HIS A 153 -16.817 -2.141 2.835 1.00 0.00 N ATOM 0 H HIS A 153 -13.816 -3.669 7.994 1.00 0.00 H new ATOM 0 HA HIS A 153 -15.767 -1.764 7.267 1.00 0.00 H new ATOM 0 HB2 HIS A 153 -13.813 -2.567 5.877 1.00 0.00 H new ATOM 0 HB3 HIS A 153 -14.612 -4.115 5.687 1.00 0.00 H new ATOM 0 HD1 HIS A 153 -15.567 -0.408 5.210 1.00 0.00 H new ATOM 0 HD2 HIS A 153 -16.167 -4.161 3.410 1.00 0.00 H new ATOM 0 HE1 HIS A 153 -16.967 -0.030 3.108 1.00 0.00 H new ATOM 2496 N ASN A 154 -16.764 -4.907 7.331 1.00 0.00 N ATOM 2497 CA ASN A 154 -17.948 -5.756 7.318 1.00 0.00 C ATOM 2498 C ASN A 154 -18.891 -5.387 8.460 1.00 0.00 C ATOM 2499 O ASN A 154 -20.108 -5.328 8.281 1.00 0.00 O ATOM 2500 CB ASN A 154 -17.533 -7.225 7.457 1.00 0.00 C ATOM 2501 CG ASN A 154 -18.732 -8.140 7.224 1.00 0.00 C ATOM 2502 OD1 ASN A 154 -19.771 -7.693 6.575 1.00 0.00 O flip ATOM 2503 ND2 ASN A 154 -18.719 -9.299 7.644 1.00 0.00 N flip ATOM 0 H ASN A 154 -15.889 -5.400 7.510 1.00 0.00 H new ATOM 0 HA ASN A 154 -18.468 -5.607 6.372 1.00 0.00 H new ATOM 0 HB2 ASN A 154 -16.746 -7.457 6.740 1.00 0.00 H new ATOM 0 HB3 ASN A 154 -17.121 -7.401 8.451 1.00 0.00 H new ATOM 0 HD21 ASN A 154 -17.906 -9.648 8.152 1.00 0.00 H new ATOM 0 HD22 ASN A 154 -19.521 -9.909 7.484 1.00 0.00 H new ATOM 2510 N CYS A 155 -18.315 -5.138 9.635 1.00 0.00 N ATOM 2511 CA CYS A 155 -19.113 -4.779 10.803 1.00 0.00 C ATOM 2512 C CYS A 155 -19.778 -3.428 10.594 1.00 0.00 C ATOM 2513 O CYS A 155 -20.892 -3.190 11.065 1.00 0.00 O ATOM 2514 CB CYS A 155 -18.236 -4.752 12.062 1.00 0.00 C ATOM 2515 SG CYS A 155 -17.327 -3.188 12.169 1.00 0.00 S ATOM 0 H CYS A 155 -17.309 -5.178 9.802 1.00 0.00 H new ATOM 0 HA CYS A 155 -19.890 -5.532 10.937 1.00 0.00 H new ATOM 0 HB2 CYS A 155 -18.858 -4.879 12.948 1.00 0.00 H new ATOM 0 HB3 CYS A 155 -17.535 -5.586 12.042 1.00 0.00 H new ATOM 0 HG CYS A 155 -16.947 -2.825 10.980 1.00 0.00 H new ATOM 2521 N LEU A 156 -19.097 -2.551 9.872 1.00 0.00 N ATOM 2522 CA LEU A 156 -19.632 -1.235 9.587 1.00 0.00 C ATOM 2523 C LEU A 156 -20.924 -1.357 8.796 1.00 0.00 C ATOM 2524 O LEU A 156 -21.921 -0.706 9.111 1.00 0.00 O ATOM 2525 CB LEU A 156 -18.571 -0.434 8.781 1.00 0.00 C ATOM 2526 CG LEU A 156 -19.227 0.520 7.753 1.00 0.00 C ATOM 2527 CD1 LEU A 156 -20.021 1.618 8.468 1.00 0.00 C ATOM 2528 CD2 LEU A 156 -18.157 1.150 6.850 1.00 0.00 C ATOM 0 H LEU A 156 -18.175 -2.729 9.475 1.00 0.00 H new ATOM 0 HA LEU A 156 -19.855 -0.712 10.517 1.00 0.00 H new ATOM 0 HB2 LEU A 156 -17.952 0.143 9.468 1.00 0.00 H new ATOM 0 HB3 LEU A 156 -17.909 -1.128 8.262 1.00 0.00 H new ATOM 0 HG LEU A 156 -19.912 -0.061 7.136 1.00 0.00 H new ATOM 0 HD11 LEU A 156 -20.475 2.279 7.729 1.00 0.00 H new ATOM 0 HD12 LEU A 156 -20.802 1.164 9.077 1.00 0.00 H new ATOM 0 HD13 LEU A 156 -19.351 2.194 9.107 1.00 0.00 H new ATOM 0 HD21 LEU A 156 -18.634 1.818 6.133 1.00 0.00 H new ATOM 0 HD22 LEU A 156 -17.453 1.716 7.460 1.00 0.00 H new ATOM 0 HD23 LEU A 156 -17.624 0.364 6.315 1.00 0.00 H new ATOM 2540 N LYS A 157 -20.895 -2.189 7.765 1.00 0.00 N ATOM 2541 CA LYS A 157 -22.068 -2.366 6.924 1.00 0.00 C ATOM 2542 C LYS A 157 -23.220 -2.973 7.701 1.00 0.00 C ATOM 2543 O LYS A 157 -24.375 -2.595 7.507 1.00 0.00 O ATOM 2544 CB LYS A 157 -21.748 -3.244 5.711 1.00 0.00 C ATOM 2545 CG LYS A 157 -20.894 -2.460 4.715 1.00 0.00 C ATOM 2546 CD LYS A 157 -20.807 -3.242 3.405 1.00 0.00 C ATOM 2547 CE LYS A 157 -20.177 -2.358 2.334 1.00 0.00 C ATOM 2548 NZ LYS A 157 -20.292 -3.027 1.005 1.00 0.00 N ATOM 0 H LYS A 157 -20.084 -2.745 7.494 1.00 0.00 H new ATOM 0 HA LYS A 157 -22.365 -1.376 6.577 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -21.219 -4.142 6.030 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -22.672 -3.571 5.234 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -21.331 -1.477 4.538 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -19.896 -2.297 5.122 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -20.212 -4.144 3.545 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -21.801 -3.561 3.092 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -20.674 -1.388 2.309 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -19.129 -2.173 2.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -19.862 -2.424 0.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -19.798 -3.942 1.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -21.295 -3.182 0.780 1.00 0.00 H new ATOM 2562 N ASN A 158 -22.905 -3.913 8.568 1.00 0.00 N ATOM 2563 CA ASN A 158 -23.933 -4.563 9.354 1.00 0.00 C ATOM 2564 C ASN A 158 -24.548 -3.574 10.338 1.00 0.00 C ATOM 2565 O ASN A 158 -25.657 -3.783 10.828 1.00 0.00 O ATOM 2566 CB ASN A 158 -23.329 -5.748 10.106 1.00 0.00 C ATOM 2567 CG ASN A 158 -23.003 -6.874 9.127 1.00 0.00 C ATOM 2568 OD1 ASN A 158 -21.756 -7.198 8.908 1.00 0.00 O flip ATOM 2569 ND2 ASN A 158 -23.907 -7.477 8.550 1.00 0.00 N flip ATOM 0 H ASN A 158 -21.956 -4.241 8.745 1.00 0.00 H new ATOM 0 HA ASN A 158 -24.718 -4.923 8.689 1.00 0.00 H new ATOM 0 HB2 ASN A 158 -22.425 -5.436 10.628 1.00 0.00 H new ATOM 0 HB3 ASN A 158 -24.028 -6.104 10.863 1.00 0.00 H new ATOM 0 HD21 ASN A 158 -24.880 -7.223 8.722 1.00 0.00 H new ATOM 0 HD22 ASN A 158 -23.684 -8.231 7.900 1.00 0.00 H new ATOM 2576 N GLY A 159 -23.824 -2.493 10.622 1.00 0.00 N ATOM 2577 CA GLY A 159 -24.321 -1.484 11.549 1.00 0.00 C ATOM 2578 C GLY A 159 -24.057 -1.902 12.988 1.00 0.00 C ATOM 2579 O GLY A 159 -24.963 -1.907 13.821 1.00 0.00 O ATOM 0 H GLY A 159 -22.904 -2.296 10.229 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -23.838 -0.528 11.348 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -25.391 -1.338 11.397 1.00 0.00 H new ATOM 2583 N GLU A 160 -22.806 -2.257 13.276 1.00 0.00 N ATOM 2584 CA GLU A 160 -22.427 -2.682 14.624 1.00 0.00 C ATOM 2585 C GLU A 160 -21.113 -2.034 15.029 1.00 0.00 C ATOM 2586 O GLU A 160 -20.122 -2.100 14.301 1.00 0.00 O ATOM 2587 CB GLU A 160 -22.295 -4.202 14.667 1.00 0.00 C ATOM 2588 CG GLU A 160 -23.664 -4.825 14.397 1.00 0.00 C ATOM 2589 CD GLU A 160 -23.552 -6.343 14.380 1.00 0.00 C ATOM 2590 OE1 GLU A 160 -22.453 -6.837 14.571 1.00 0.00 O ATOM 2591 OE2 GLU A 160 -24.565 -6.990 14.175 1.00 0.00 O ATOM 0 H GLU A 160 -22.042 -2.259 12.600 1.00 0.00 H new ATOM 0 HA GLU A 160 -23.201 -2.370 15.325 1.00 0.00 H new ATOM 0 HB2 GLU A 160 -21.574 -4.539 13.922 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -21.921 -4.521 15.640 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -24.372 -4.513 15.165 1.00 0.00 H new ATOM 0 HG3 GLU A 160 -24.052 -4.470 13.442 1.00 0.00 H new ATOM 2598 N THR A 161 -21.106 -1.406 16.196 1.00 0.00 N ATOM 2599 CA THR A 161 -19.900 -0.751 16.677 1.00 0.00 C ATOM 2600 C THR A 161 -18.719 -1.737 16.682 1.00 0.00 C ATOM 2601 O THR A 161 -18.791 -2.771 17.344 1.00 0.00 O ATOM 2602 CB THR A 161 -20.119 -0.198 18.091 1.00 0.00 C ATOM 2603 OG1 THR A 161 -19.006 0.606 18.451 1.00 0.00 O ATOM 2604 CG2 THR A 161 -20.258 -1.346 19.098 1.00 0.00 C ATOM 0 H THR A 161 -21.910 -1.337 16.819 1.00 0.00 H new ATOM 0 HA THR A 161 -19.669 0.075 16.005 1.00 0.00 H new ATOM 0 HB THR A 161 -21.033 0.395 18.103 1.00 0.00 H new ATOM 0 HG1 THR A 161 -19.140 0.965 19.353 1.00 0.00 H new ATOM 0 HG21 THR A 161 -20.413 -0.937 20.097 1.00 0.00 H new ATOM 0 HG22 THR A 161 -21.110 -1.969 18.825 1.00 0.00 H new ATOM 0 HG23 THR A 161 -19.350 -1.949 19.090 1.00 0.00 H new ATOM 2612 N PRO A 162 -17.634 -1.451 15.983 1.00 0.00 N ATOM 2613 CA PRO A 162 -16.445 -2.361 15.959 1.00 0.00 C ATOM 2614 C PRO A 162 -16.010 -2.793 17.366 1.00 0.00 C ATOM 2615 O PRO A 162 -15.984 -1.985 18.294 1.00 0.00 O ATOM 2616 CB PRO A 162 -15.344 -1.513 15.294 1.00 0.00 C ATOM 2617 CG PRO A 162 -16.069 -0.502 14.462 1.00 0.00 C ATOM 2618 CD PRO A 162 -17.425 -0.260 15.133 1.00 0.00 C ATOM 0 HA PRO A 162 -16.661 -3.289 15.429 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -14.716 -1.029 16.042 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -14.689 -2.131 14.679 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -15.499 0.425 14.398 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -16.202 -0.865 13.443 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -17.417 0.655 15.726 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -18.220 -0.154 14.395 1.00 0.00 H new ATOM 2626 N GLN A 163 -15.664 -4.075 17.504 1.00 0.00 N ATOM 2627 CA GLN A 163 -15.220 -4.621 18.787 1.00 0.00 C ATOM 2628 C GLN A 163 -13.707 -4.799 18.785 1.00 0.00 C ATOM 2629 O GLN A 163 -13.036 -4.490 17.798 1.00 0.00 O ATOM 2630 CB GLN A 163 -15.891 -5.976 19.043 1.00 0.00 C ATOM 2631 CG GLN A 163 -15.845 -6.811 17.765 1.00 0.00 C ATOM 2632 CD GLN A 163 -16.220 -8.255 18.070 1.00 0.00 C ATOM 2633 OE1 GLN A 163 -17.373 -8.651 17.887 1.00 0.00 O ATOM 2634 NE2 GLN A 163 -15.311 -9.068 18.535 1.00 0.00 N ATOM 0 H GLN A 163 -15.683 -4.754 16.743 1.00 0.00 H new ATOM 0 HA GLN A 163 -15.500 -3.924 19.577 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -15.382 -6.500 19.852 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -16.924 -5.829 19.358 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -16.531 -6.397 17.026 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -14.846 -6.770 17.330 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -14.358 -8.736 18.685 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -15.553 -10.036 18.749 1.00 0.00 H new ATOM 2644 N GLY B 154 -4.318 -17.883 16.709 1.00 0.00 N ATOM 2645 CA GLY B 154 -5.479 -18.558 16.137 1.00 0.00 C ATOM 2646 C GLY B 154 -6.396 -17.551 15.459 1.00 0.00 C ATOM 2647 O GLY B 154 -6.995 -16.707 16.124 1.00 0.00 O ATOM 0 HA2 GLY B 154 -5.153 -19.307 15.415 1.00 0.00 H new ATOM 0 HA3 GLY B 154 -6.023 -19.086 16.920 1.00 0.00 H new ATOM 2651 N THR B 155 -6.497 -17.631 14.132 1.00 0.00 N ATOM 2652 CA THR B 155 -7.342 -16.699 13.382 1.00 0.00 C ATOM 2653 C THR B 155 -8.663 -17.379 12.960 1.00 0.00 C ATOM 2654 O THR B 155 -8.640 -18.478 12.403 1.00 0.00 O ATOM 2655 CB THR B 155 -6.579 -16.182 12.130 1.00 0.00 C ATOM 2656 OG1 THR B 155 -5.300 -16.795 12.062 1.00 0.00 O ATOM 2657 CG2 THR B 155 -6.408 -14.657 12.208 1.00 0.00 C ATOM 0 H THR B 155 -6.012 -18.322 13.560 1.00 0.00 H new ATOM 0 HA THR B 155 -7.583 -15.853 14.026 1.00 0.00 H new ATOM 0 HB THR B 155 -7.154 -16.434 11.239 1.00 0.00 H new ATOM 0 HG1 THR B 155 -4.822 -16.468 11.271 1.00 0.00 H new ATOM 0 HG21 THR B 155 -5.872 -14.305 11.326 1.00 0.00 H new ATOM 0 HG22 THR B 155 -7.388 -14.183 12.250 1.00 0.00 H new ATOM 0 HG23 THR B 155 -5.842 -14.400 13.103 1.00 0.00 H new ATOM 2665 N PRO B 156 -9.804 -16.751 13.188 1.00 0.00 N ATOM 2666 CA PRO B 156 -11.123 -17.327 12.781 1.00 0.00 C ATOM 2667 C PRO B 156 -11.092 -17.875 11.350 1.00 0.00 C ATOM 2668 O PRO B 156 -10.157 -17.607 10.593 1.00 0.00 O ATOM 2669 CB PRO B 156 -12.089 -16.135 12.886 1.00 0.00 C ATOM 2670 CG PRO B 156 -11.488 -15.225 13.912 1.00 0.00 C ATOM 2671 CD PRO B 156 -9.971 -15.446 13.865 1.00 0.00 C ATOM 0 HA PRO B 156 -11.411 -18.172 13.406 1.00 0.00 H new ATOM 0 HB2 PRO B 156 -12.195 -15.629 11.926 1.00 0.00 H new ATOM 0 HB3 PRO B 156 -13.085 -16.462 13.186 1.00 0.00 H new ATOM 0 HG2 PRO B 156 -11.734 -14.185 13.698 1.00 0.00 H new ATOM 0 HG3 PRO B 156 -11.881 -15.448 14.904 1.00 0.00 H new ATOM 0 HD2 PRO B 156 -9.471 -14.648 13.316 1.00 0.00 H new ATOM 0 HD3 PRO B 156 -9.542 -15.461 14.867 1.00 0.00 H new ATOM 2679 N GLU B 157 -12.123 -18.638 10.993 1.00 0.00 N ATOM 2680 CA GLU B 157 -12.219 -19.222 9.657 1.00 0.00 C ATOM 2681 C GLU B 157 -12.808 -18.216 8.671 1.00 0.00 C ATOM 2682 O GLU B 157 -13.994 -17.900 8.726 1.00 0.00 O ATOM 2683 CB GLU B 157 -13.102 -20.478 9.709 1.00 0.00 C ATOM 2684 CG GLU B 157 -14.515 -20.114 10.204 1.00 0.00 C ATOM 2685 CD GLU B 157 -15.195 -21.336 10.821 1.00 0.00 C ATOM 2686 OE1 GLU B 157 -14.531 -22.056 11.547 1.00 0.00 O ATOM 2687 OE2 GLU B 157 -16.372 -21.530 10.559 1.00 0.00 O ATOM 0 H GLU B 157 -12.903 -18.866 11.610 1.00 0.00 H new ATOM 0 HA GLU B 157 -11.218 -19.491 9.319 1.00 0.00 H new ATOM 0 HB2 GLU B 157 -13.161 -20.931 8.720 1.00 0.00 H new ATOM 0 HB3 GLU B 157 -12.655 -21.218 10.373 1.00 0.00 H new ATOM 0 HG2 GLU B 157 -14.454 -19.313 10.941 1.00 0.00 H new ATOM 0 HG3 GLU B 157 -15.113 -19.738 9.373 1.00 0.00 H new ATOM 2694 N LEU B 158 -11.968 -17.697 7.778 1.00 0.00 N ATOM 2695 CA LEU B 158 -12.416 -16.713 6.792 1.00 0.00 C ATOM 2696 C LEU B 158 -12.340 -17.318 5.395 1.00 0.00 C ATOM 2697 O LEU B 158 -11.290 -17.804 4.975 1.00 0.00 O ATOM 2698 CB LEU B 158 -11.519 -15.473 6.868 1.00 0.00 C ATOM 2699 CG LEU B 158 -11.414 -14.989 8.323 1.00 0.00 C ATOM 2700 CD1 LEU B 158 -10.310 -13.936 8.427 1.00 0.00 C ATOM 2701 CD2 LEU B 158 -12.743 -14.372 8.777 1.00 0.00 C ATOM 0 H LEU B 158 -10.979 -17.939 7.716 1.00 0.00 H new ATOM 0 HA LEU B 158 -13.447 -16.428 7.003 1.00 0.00 H new ATOM 0 HB2 LEU B 158 -10.527 -15.707 6.481 1.00 0.00 H new ATOM 0 HB3 LEU B 158 -11.927 -14.680 6.241 1.00 0.00 H new ATOM 0 HG LEU B 158 -11.181 -15.840 8.962 1.00 0.00 H new ATOM 0 HD11 LEU B 158 -10.233 -13.590 9.458 1.00 0.00 H new ATOM 0 HD12 LEU B 158 -9.360 -14.373 8.119 1.00 0.00 H new ATOM 0 HD13 LEU B 158 -10.549 -13.093 7.779 1.00 0.00 H new ATOM 0 HD21 LEU B 158 -12.653 -14.034 9.809 1.00 0.00 H new ATOM 0 HD22 LEU B 158 -12.988 -13.524 8.137 1.00 0.00 H new ATOM 0 HD23 LEU B 158 -13.534 -15.119 8.707 1.00 0.00 H new ATOM 2713 N ASP B 159 -13.457 -17.293 4.678 1.00 0.00 N ATOM 2714 CA ASP B 159 -13.492 -17.849 3.335 1.00 0.00 C ATOM 2715 C ASP B 159 -12.710 -16.953 2.383 1.00 0.00 C ATOM 2716 O ASP B 159 -12.906 -15.739 2.360 1.00 0.00 O ATOM 2717 CB ASP B 159 -14.940 -17.977 2.858 1.00 0.00 C ATOM 2718 CG ASP B 159 -15.788 -18.641 3.938 1.00 0.00 C ATOM 2719 OD1 ASP B 159 -15.331 -19.619 4.505 1.00 0.00 O ATOM 2720 OD2 ASP B 159 -16.882 -18.159 4.184 1.00 0.00 O ATOM 0 H ASP B 159 -14.340 -16.898 5.001 1.00 0.00 H new ATOM 0 HA ASP B 159 -13.036 -18.839 3.350 1.00 0.00 H new ATOM 0 HB2 ASP B 159 -15.342 -16.992 2.623 1.00 0.00 H new ATOM 0 HB3 ASP B 159 -14.979 -18.565 1.941 1.00 0.00 H new ATOM 2725 N GLU B 160 -11.830 -17.560 1.597 1.00 0.00 N ATOM 2726 CA GLU B 160 -11.014 -16.810 0.649 1.00 0.00 C ATOM 2727 C GLU B 160 -11.892 -16.015 -0.313 1.00 0.00 C ATOM 2728 O GLU B 160 -11.569 -14.879 -0.662 1.00 0.00 O ATOM 2729 CB GLU B 160 -10.126 -17.773 -0.142 1.00 0.00 C ATOM 2730 CG GLU B 160 -11.005 -18.760 -0.912 1.00 0.00 C ATOM 2731 CD GLU B 160 -10.143 -19.857 -1.527 1.00 0.00 C ATOM 2732 OE1 GLU B 160 -9.625 -19.639 -2.609 1.00 0.00 O ATOM 2733 OE2 GLU B 160 -10.016 -20.900 -0.908 1.00 0.00 O ATOM 0 H GLU B 160 -11.663 -18.566 1.596 1.00 0.00 H new ATOM 0 HA GLU B 160 -10.391 -16.111 1.207 1.00 0.00 H new ATOM 0 HB2 GLU B 160 -9.493 -17.217 -0.834 1.00 0.00 H new ATOM 0 HB3 GLU B 160 -9.462 -18.311 0.534 1.00 0.00 H new ATOM 0 HG2 GLU B 160 -11.745 -19.200 -0.243 1.00 0.00 H new ATOM 0 HG3 GLU B 160 -11.554 -18.236 -1.694 1.00 0.00 H new ATOM 2740 N ASP B 161 -13.001 -16.610 -0.729 1.00 0.00 N ATOM 2741 CA ASP B 161 -13.912 -15.939 -1.648 1.00 0.00 C ATOM 2742 C ASP B 161 -14.575 -14.740 -0.983 1.00 0.00 C ATOM 2743 O ASP B 161 -14.587 -13.637 -1.534 1.00 0.00 O ATOM 2744 CB ASP B 161 -14.993 -16.918 -2.104 1.00 0.00 C ATOM 2745 CG ASP B 161 -14.354 -18.146 -2.742 1.00 0.00 C ATOM 2746 OD1 ASP B 161 -14.141 -18.122 -3.943 1.00 0.00 O ATOM 2747 OD2 ASP B 161 -14.088 -19.093 -2.020 1.00 0.00 O ATOM 0 H ASP B 161 -13.291 -17.547 -0.449 1.00 0.00 H new ATOM 0 HA ASP B 161 -13.335 -15.590 -2.504 1.00 0.00 H new ATOM 0 HB2 ASP B 161 -15.605 -17.218 -1.253 1.00 0.00 H new ATOM 0 HB3 ASP B 161 -15.657 -16.431 -2.819 1.00 0.00 H new ATOM 2752 N ASP B 162 -15.128 -14.949 0.204 1.00 0.00 N ATOM 2753 CA ASP B 162 -15.788 -13.863 0.912 1.00 0.00 C ATOM 2754 C ASP B 162 -14.787 -12.775 1.268 1.00 0.00 C ATOM 2755 O ASP B 162 -15.113 -11.594 1.222 1.00 0.00 O ATOM 2756 CB ASP B 162 -16.429 -14.384 2.201 1.00 0.00 C ATOM 2757 CG ASP B 162 -17.191 -13.263 2.906 1.00 0.00 C ATOM 2758 OD1 ASP B 162 -18.185 -12.814 2.362 1.00 0.00 O ATOM 2759 OD2 ASP B 162 -16.768 -12.876 3.983 1.00 0.00 O ATOM 0 H ASP B 162 -15.133 -15.846 0.690 1.00 0.00 H new ATOM 0 HA ASP B 162 -16.557 -13.451 0.258 1.00 0.00 H new ATOM 0 HB2 ASP B 162 -17.108 -15.205 1.971 1.00 0.00 H new ATOM 0 HB3 ASP B 162 -15.660 -14.782 2.863 1.00 0.00 H new ATOM 2764 N LEU B 163 -13.576 -13.185 1.643 1.00 0.00 N ATOM 2765 CA LEU B 163 -12.542 -12.231 2.038 1.00 0.00 C ATOM 2766 C LEU B 163 -12.239 -11.275 0.885 1.00 0.00 C ATOM 2767 O LEU B 163 -12.137 -10.066 1.077 1.00 0.00 O ATOM 2768 CB LEU B 163 -11.263 -12.990 2.452 1.00 0.00 C ATOM 2769 CG LEU B 163 -10.475 -12.201 3.509 1.00 0.00 C ATOM 2770 CD1 LEU B 163 -9.289 -13.046 3.992 1.00 0.00 C ATOM 2771 CD2 LEU B 163 -9.964 -10.881 2.919 1.00 0.00 C ATOM 0 H LEU B 163 -13.289 -14.163 1.681 1.00 0.00 H new ATOM 0 HA LEU B 163 -12.900 -11.649 2.887 1.00 0.00 H new ATOM 0 HB2 LEU B 163 -11.529 -13.970 2.848 1.00 0.00 H new ATOM 0 HB3 LEU B 163 -10.636 -13.159 1.576 1.00 0.00 H new ATOM 0 HG LEU B 163 -11.132 -11.976 4.349 1.00 0.00 H new ATOM 0 HD11 LEU B 163 -8.727 -12.489 4.742 1.00 0.00 H new ATOM 0 HD12 LEU B 163 -9.658 -13.974 4.429 1.00 0.00 H new ATOM 0 HD13 LEU B 163 -8.638 -13.276 3.148 1.00 0.00 H new ATOM 0 HD21 LEU B 163 -9.408 -10.334 3.680 1.00 0.00 H new ATOM 0 HD22 LEU B 163 -9.311 -11.090 2.072 1.00 0.00 H new ATOM 0 HD23 LEU B 163 -10.810 -10.280 2.585 1.00 0.00 H new ATOM 2783 N GLU B 164 -12.118 -11.824 -0.318 1.00 0.00 N ATOM 2784 CA GLU B 164 -11.842 -11.007 -1.491 1.00 0.00 C ATOM 2785 C GLU B 164 -13.006 -10.065 -1.788 1.00 0.00 C ATOM 2786 O GLU B 164 -12.802 -8.936 -2.238 1.00 0.00 O ATOM 2787 CB GLU B 164 -11.587 -11.909 -2.698 1.00 0.00 C ATOM 2788 CG GLU B 164 -10.251 -12.631 -2.521 1.00 0.00 C ATOM 2789 CD GLU B 164 -10.037 -13.612 -3.666 1.00 0.00 C ATOM 2790 OE1 GLU B 164 -10.882 -13.657 -4.546 1.00 0.00 O ATOM 2791 OE2 GLU B 164 -9.034 -14.306 -3.648 1.00 0.00 O ATOM 0 H GLU B 164 -12.206 -12.823 -0.505 1.00 0.00 H new ATOM 0 HA GLU B 164 -10.956 -10.404 -1.289 1.00 0.00 H new ATOM 0 HB2 GLU B 164 -12.394 -12.635 -2.800 1.00 0.00 H new ATOM 0 HB3 GLU B 164 -11.574 -11.316 -3.612 1.00 0.00 H new ATOM 0 HG2 GLU B 164 -9.437 -11.907 -2.494 1.00 0.00 H new ATOM 0 HG3 GLU B 164 -10.237 -13.161 -1.569 1.00 0.00 H new ATOM 2798 N ALA B 165 -14.218 -10.540 -1.543 1.00 0.00 N ATOM 2799 CA ALA B 165 -15.414 -9.741 -1.794 1.00 0.00 C ATOM 2800 C ALA B 165 -15.395 -8.453 -0.975 1.00 0.00 C ATOM 2801 O ALA B 165 -15.665 -7.367 -1.493 1.00 0.00 O ATOM 2802 CB ALA B 165 -16.658 -10.545 -1.420 1.00 0.00 C ATOM 0 H ALA B 165 -14.402 -11.472 -1.172 1.00 0.00 H new ATOM 0 HA ALA B 165 -15.433 -9.486 -2.853 1.00 0.00 H new ATOM 0 HB1 ALA B 165 -17.549 -9.946 -1.609 1.00 0.00 H new ATOM 0 HB2 ALA B 165 -16.698 -11.454 -2.021 1.00 0.00 H new ATOM 0 HB3 ALA B 165 -16.616 -10.810 -0.364 1.00 0.00 H new ATOM 2808 N GLU B 166 -15.076 -8.590 0.306 1.00 0.00 N ATOM 2809 CA GLU B 166 -15.025 -7.436 1.202 1.00 0.00 C ATOM 2810 C GLU B 166 -13.819 -6.572 0.863 1.00 0.00 C ATOM 2811 O GLU B 166 -13.879 -5.344 0.938 1.00 0.00 O ATOM 2812 CB GLU B 166 -14.956 -7.883 2.687 1.00 0.00 C ATOM 2813 CG GLU B 166 -15.214 -9.386 2.801 1.00 0.00 C ATOM 2814 CD GLU B 166 -15.585 -9.773 4.234 1.00 0.00 C ATOM 2815 OE1 GLU B 166 -16.582 -9.269 4.727 1.00 0.00 O ATOM 2816 OE2 GLU B 166 -14.873 -10.578 4.814 1.00 0.00 O ATOM 0 H GLU B 166 -14.850 -9.481 0.748 1.00 0.00 H new ATOM 0 HA GLU B 166 -15.938 -6.856 1.064 1.00 0.00 H new ATOM 0 HB2 GLU B 166 -13.977 -7.643 3.101 1.00 0.00 H new ATOM 0 HB3 GLU B 166 -15.693 -7.335 3.274 1.00 0.00 H new ATOM 0 HG2 GLU B 166 -16.018 -9.673 2.124 1.00 0.00 H new ATOM 0 HG3 GLU B 166 -14.325 -9.935 2.491 1.00 0.00 H new ATOM 2823 N LEU B 167 -12.709 -7.217 0.516 1.00 0.00 N ATOM 2824 CA LEU B 167 -11.495 -6.479 0.207 1.00 0.00 C ATOM 2825 C LEU B 167 -11.715 -5.587 -1.013 1.00 0.00 C ATOM 2826 O LEU B 167 -11.511 -4.376 -0.954 1.00 0.00 O ATOM 2827 CB LEU B 167 -10.349 -7.472 -0.064 1.00 0.00 C ATOM 2828 CG LEU B 167 -9.001 -6.903 0.429 1.00 0.00 C ATOM 2829 CD1 LEU B 167 -8.759 -5.511 -0.165 1.00 0.00 C ATOM 2830 CD2 LEU B 167 -8.984 -6.822 1.971 1.00 0.00 C ATOM 0 H LEU B 167 -12.627 -8.231 0.443 1.00 0.00 H new ATOM 0 HA LEU B 167 -11.233 -5.847 1.055 1.00 0.00 H new ATOM 0 HB2 LEU B 167 -10.555 -8.417 0.438 1.00 0.00 H new ATOM 0 HB3 LEU B 167 -10.291 -7.684 -1.132 1.00 0.00 H new ATOM 0 HG LEU B 167 -8.206 -7.572 0.100 1.00 0.00 H new ATOM 0 HD11 LEU B 167 -7.805 -5.124 0.192 1.00 0.00 H new ATOM 0 HD12 LEU B 167 -8.739 -5.578 -1.253 1.00 0.00 H new ATOM 0 HD13 LEU B 167 -9.561 -4.840 0.142 1.00 0.00 H new ATOM 0 HD21 LEU B 167 -8.027 -6.419 2.304 1.00 0.00 H new ATOM 0 HD22 LEU B 167 -9.790 -6.171 2.310 1.00 0.00 H new ATOM 0 HD23 LEU B 167 -9.123 -7.819 2.389 1.00 0.00 H new ATOM 2842 N ASP B 168 -12.130 -6.200 -2.117 1.00 0.00 N ATOM 2843 CA ASP B 168 -12.366 -5.456 -3.345 1.00 0.00 C ATOM 2844 C ASP B 168 -13.348 -4.323 -3.093 1.00 0.00 C ATOM 2845 O ASP B 168 -13.151 -3.199 -3.560 1.00 0.00 O ATOM 2846 CB ASP B 168 -12.924 -6.392 -4.417 1.00 0.00 C ATOM 2847 CG ASP B 168 -12.898 -5.704 -5.778 1.00 0.00 C ATOM 2848 OD1 ASP B 168 -12.167 -4.736 -5.916 1.00 0.00 O ATOM 2849 OD2 ASP B 168 -13.607 -6.156 -6.662 1.00 0.00 O ATOM 0 H ASP B 168 -12.308 -7.202 -2.185 1.00 0.00 H new ATOM 0 HA ASP B 168 -11.421 -5.035 -3.688 1.00 0.00 H new ATOM 0 HB2 ASP B 168 -12.335 -7.309 -4.453 1.00 0.00 H new ATOM 0 HB3 ASP B 168 -13.945 -6.679 -4.165 1.00 0.00 H new ATOM 2854 N ALA B 169 -14.402 -4.620 -2.342 1.00 0.00 N ATOM 2855 CA ALA B 169 -15.402 -3.612 -2.027 1.00 0.00 C ATOM 2856 C ALA B 169 -14.756 -2.426 -1.326 1.00 0.00 C ATOM 2857 O ALA B 169 -15.017 -1.271 -1.669 1.00 0.00 O ATOM 2858 CB ALA B 169 -16.478 -4.213 -1.126 1.00 0.00 C ATOM 0 H ALA B 169 -14.584 -5.541 -1.944 1.00 0.00 H new ATOM 0 HA ALA B 169 -15.856 -3.269 -2.957 1.00 0.00 H new ATOM 0 HB1 ALA B 169 -17.224 -3.453 -0.894 1.00 0.00 H new ATOM 0 HB2 ALA B 169 -16.957 -5.047 -1.638 1.00 0.00 H new ATOM 0 HB3 ALA B 169 -16.022 -4.568 -0.202 1.00 0.00 H new ATOM 2864 N LEU B 170 -13.929 -2.713 -0.330 1.00 0.00 N ATOM 2865 CA LEU B 170 -13.272 -1.655 0.421 1.00 0.00 C ATOM 2866 C LEU B 170 -12.454 -0.780 -0.515 1.00 0.00 C ATOM 2867 O LEU B 170 -12.482 0.441 -0.408 1.00 0.00 O ATOM 2868 CB LEU B 170 -12.333 -2.269 1.469 1.00 0.00 C ATOM 2869 CG LEU B 170 -11.721 -1.163 2.372 1.00 0.00 C ATOM 2870 CD1 LEU B 170 -12.498 -1.057 3.688 1.00 0.00 C ATOM 2871 CD2 LEU B 170 -10.251 -1.486 2.681 1.00 0.00 C ATOM 0 H LEU B 170 -13.699 -3.659 -0.026 1.00 0.00 H new ATOM 0 HA LEU B 170 -14.035 -1.052 0.913 1.00 0.00 H new ATOM 0 HB2 LEU B 170 -12.882 -2.984 2.082 1.00 0.00 H new ATOM 0 HB3 LEU B 170 -11.536 -2.822 0.971 1.00 0.00 H new ATOM 0 HG LEU B 170 -11.783 -0.214 1.839 1.00 0.00 H new ATOM 0 HD11 LEU B 170 -12.057 -0.278 4.309 1.00 0.00 H new ATOM 0 HD12 LEU B 170 -13.538 -0.808 3.477 1.00 0.00 H new ATOM 0 HD13 LEU B 170 -12.453 -2.010 4.215 1.00 0.00 H new ATOM 0 HD21 LEU B 170 -9.832 -0.704 3.315 1.00 0.00 H new ATOM 0 HD22 LEU B 170 -10.190 -2.444 3.198 1.00 0.00 H new ATOM 0 HD23 LEU B 170 -9.687 -1.540 1.750 1.00 0.00 H new ATOM 2883 N GLY B 171 -11.729 -1.406 -1.430 1.00 0.00 N ATOM 2884 CA GLY B 171 -10.906 -0.655 -2.365 1.00 0.00 C ATOM 2885 C GLY B 171 -11.746 0.366 -3.122 1.00 0.00 C ATOM 2886 O GLY B 171 -11.332 1.507 -3.312 1.00 0.00 O ATOM 0 H GLY B 171 -11.693 -2.419 -1.545 1.00 0.00 H new ATOM 0 HA2 GLY B 171 -10.106 -0.147 -1.826 1.00 0.00 H new ATOM 0 HA3 GLY B 171 -10.432 -1.338 -3.070 1.00 0.00 H new ATOM 2890 N ASP B 172 -12.926 -0.056 -3.548 1.00 0.00 N ATOM 2891 CA ASP B 172 -13.825 0.828 -4.292 1.00 0.00 C ATOM 2892 C ASP B 172 -14.179 2.066 -3.468 1.00 0.00 C ATOM 2893 O ASP B 172 -14.070 3.199 -3.947 1.00 0.00 O ATOM 2894 CB ASP B 172 -15.113 0.085 -4.648 1.00 0.00 C ATOM 2895 CG ASP B 172 -16.031 0.989 -5.464 1.00 0.00 C ATOM 2896 OD1 ASP B 172 -15.641 2.116 -5.726 1.00 0.00 O ATOM 2897 OD2 ASP B 172 -17.113 0.545 -5.812 1.00 0.00 O ATOM 0 H ASP B 172 -13.287 -0.998 -3.395 1.00 0.00 H new ATOM 0 HA ASP B 172 -13.312 1.141 -5.201 1.00 0.00 H new ATOM 0 HB2 ASP B 172 -14.878 -0.815 -5.216 1.00 0.00 H new ATOM 0 HB3 ASP B 172 -15.620 -0.236 -3.738 1.00 0.00 H new ATOM 2902 N GLU B 173 -14.589 1.836 -2.227 1.00 0.00 N ATOM 2903 CA GLU B 173 -14.950 2.943 -1.342 1.00 0.00 C ATOM 2904 C GLU B 173 -13.711 3.764 -1.008 1.00 0.00 C ATOM 2905 O GLU B 173 -13.749 4.993 -0.987 1.00 0.00 O ATOM 2906 CB GLU B 173 -15.630 2.400 -0.050 1.00 0.00 C ATOM 2907 CG GLU B 173 -14.673 2.417 1.171 1.00 0.00 C ATOM 2908 CD GLU B 173 -15.349 1.789 2.390 1.00 0.00 C ATOM 2909 OE1 GLU B 173 -16.460 2.192 2.705 1.00 0.00 O ATOM 2910 OE2 GLU B 173 -14.750 0.913 3.000 1.00 0.00 O ATOM 0 H GLU B 173 -14.680 0.909 -1.812 1.00 0.00 H new ATOM 0 HA GLU B 173 -15.664 3.592 -1.850 1.00 0.00 H new ATOM 0 HB2 GLU B 173 -16.512 3.001 0.174 1.00 0.00 H new ATOM 0 HB3 GLU B 173 -15.975 1.381 -0.224 1.00 0.00 H new ATOM 0 HG2 GLU B 173 -13.760 1.871 0.933 1.00 0.00 H new ATOM 0 HG3 GLU B 173 -14.381 3.442 1.398 1.00 0.00 H new ATOM 2917 N LEU B 174 -12.625 3.062 -0.714 1.00 0.00 N ATOM 2918 CA LEU B 174 -11.378 3.720 -0.339 1.00 0.00 C ATOM 2919 C LEU B 174 -10.843 4.536 -1.500 1.00 0.00 C ATOM 2920 O LEU B 174 -10.342 5.647 -1.315 1.00 0.00 O ATOM 2921 CB LEU B 174 -10.353 2.657 0.112 1.00 0.00 C ATOM 2922 CG LEU B 174 -9.423 3.226 1.208 1.00 0.00 C ATOM 2923 CD1 LEU B 174 -10.141 3.167 2.574 1.00 0.00 C ATOM 2924 CD2 LEU B 174 -8.107 2.407 1.258 1.00 0.00 C ATOM 0 H LEU B 174 -12.580 2.043 -0.727 1.00 0.00 H new ATOM 0 HA LEU B 174 -11.562 4.403 0.490 1.00 0.00 H new ATOM 0 HB2 LEU B 174 -10.875 1.779 0.491 1.00 0.00 H new ATOM 0 HB3 LEU B 174 -9.760 2.331 -0.742 1.00 0.00 H new ATOM 0 HG LEU B 174 -9.181 4.263 0.977 1.00 0.00 H new ATOM 0 HD11 LEU B 174 -9.486 3.568 3.347 1.00 0.00 H new ATOM 0 HD12 LEU B 174 -11.055 3.759 2.530 1.00 0.00 H new ATOM 0 HD13 LEU B 174 -10.390 2.132 2.810 1.00 0.00 H new ATOM 0 HD21 LEU B 174 -7.455 2.812 2.032 1.00 0.00 H new ATOM 0 HD22 LEU B 174 -8.335 1.365 1.484 1.00 0.00 H new ATOM 0 HD23 LEU B 174 -7.604 2.467 0.293 1.00 0.00 H new ATOM 2936 N LEU B 175 -10.966 3.989 -2.693 1.00 0.00 N ATOM 2937 CA LEU B 175 -10.504 4.674 -3.878 1.00 0.00 C ATOM 2938 C LEU B 175 -11.237 5.990 -4.031 1.00 0.00 C ATOM 2939 O LEU B 175 -10.634 7.008 -4.366 1.00 0.00 O ATOM 2940 CB LEU B 175 -10.752 3.799 -5.112 1.00 0.00 C ATOM 2941 CG LEU B 175 -10.421 4.574 -6.397 1.00 0.00 C ATOM 2942 CD1 LEU B 175 -8.916 4.847 -6.475 1.00 0.00 C ATOM 2943 CD2 LEU B 175 -10.874 3.759 -7.613 1.00 0.00 C ATOM 0 H LEU B 175 -11.382 3.074 -2.865 1.00 0.00 H new ATOM 0 HA LEU B 175 -9.436 4.869 -3.783 1.00 0.00 H new ATOM 0 HB2 LEU B 175 -10.140 2.899 -5.056 1.00 0.00 H new ATOM 0 HB3 LEU B 175 -11.793 3.476 -5.133 1.00 0.00 H new ATOM 0 HG LEU B 175 -10.946 5.529 -6.388 1.00 0.00 H new ATOM 0 HD11 LEU B 175 -8.693 5.397 -7.389 1.00 0.00 H new ATOM 0 HD12 LEU B 175 -8.608 5.438 -5.612 1.00 0.00 H new ATOM 0 HD13 LEU B 175 -8.374 3.901 -6.479 1.00 0.00 H new ATOM 0 HD21 LEU B 175 -10.640 4.307 -8.526 1.00 0.00 H new ATOM 0 HD22 LEU B 175 -10.355 2.800 -7.622 1.00 0.00 H new ATOM 0 HD23 LEU B 175 -11.949 3.589 -7.557 1.00 0.00 H new ATOM 2955 N ALA B 176 -12.543 5.977 -3.797 1.00 0.00 N ATOM 2956 CA ALA B 176 -13.328 7.189 -3.933 1.00 0.00 C ATOM 2957 C ALA B 176 -13.037 8.174 -2.809 1.00 0.00 C ATOM 2958 O ALA B 176 -12.995 9.380 -3.028 1.00 0.00 O ATOM 2959 CB ALA B 176 -14.808 6.831 -3.935 1.00 0.00 C ATOM 0 H ALA B 176 -13.072 5.151 -3.516 1.00 0.00 H new ATOM 0 HA ALA B 176 -13.057 7.669 -4.873 1.00 0.00 H new ATOM 0 HB1 ALA B 176 -15.402 7.739 -4.037 1.00 0.00 H new ATOM 0 HB2 ALA B 176 -15.020 6.163 -4.770 1.00 0.00 H new ATOM 0 HB3 ALA B 176 -15.063 6.334 -2.999 1.00 0.00 H new ATOM 3026 N TYR B 182 -4.848 11.783 8.366 1.00 0.00 N ATOM 3027 CA TYR B 182 -4.078 10.933 9.270 1.00 0.00 C ATOM 3028 C TYR B 182 -2.830 10.414 8.568 1.00 0.00 C ATOM 3029 O TYR B 182 -1.799 10.181 9.202 1.00 0.00 O ATOM 3030 CB TYR B 182 -4.940 9.754 9.742 1.00 0.00 C ATOM 3031 CG TYR B 182 -5.870 10.213 10.846 1.00 0.00 C ATOM 3032 CD1 TYR B 182 -6.871 11.152 10.568 1.00 0.00 C ATOM 3033 CD2 TYR B 182 -5.734 9.701 12.144 1.00 0.00 C ATOM 3034 CE1 TYR B 182 -7.731 11.582 11.586 1.00 0.00 C ATOM 3035 CE2 TYR B 182 -6.595 10.131 13.161 1.00 0.00 C ATOM 3036 CZ TYR B 182 -7.593 11.070 12.881 1.00 0.00 C ATOM 3037 OH TYR B 182 -8.443 11.495 13.884 1.00 0.00 O ATOM 0 HA TYR B 182 -3.776 11.523 10.135 1.00 0.00 H new ATOM 0 HB2 TYR B 182 -5.518 9.356 8.908 1.00 0.00 H new ATOM 0 HB3 TYR B 182 -4.303 8.946 10.102 1.00 0.00 H new ATOM 0 HD1 TYR B 182 -6.980 11.545 9.568 1.00 0.00 H new ATOM 0 HD2 TYR B 182 -4.965 8.974 12.360 1.00 0.00 H new ATOM 0 HE1 TYR B 182 -8.501 12.309 11.372 1.00 0.00 H new ATOM 0 HE2 TYR B 182 -6.489 9.738 14.161 1.00 0.00 H new ATOM 0 HH TYR B 182 -8.213 11.041 14.722 1.00 0.00 H new ATOM 3047 N LEU B 183 -2.917 10.249 7.255 1.00 0.00 N ATOM 3048 CA LEU B 183 -1.777 9.771 6.487 1.00 0.00 C ATOM 3049 C LEU B 183 -0.615 10.752 6.595 1.00 0.00 C ATOM 3050 O LEU B 183 0.537 10.350 6.759 1.00 0.00 O ATOM 3051 CB LEU B 183 -2.178 9.590 5.014 1.00 0.00 C ATOM 3052 CG LEU B 183 -2.842 8.219 4.807 1.00 0.00 C ATOM 3053 CD1 LEU B 183 -3.447 8.163 3.400 1.00 0.00 C ATOM 3054 CD2 LEU B 183 -1.804 7.083 4.987 1.00 0.00 C ATOM 0 H LEU B 183 -3.755 10.437 6.705 1.00 0.00 H new ATOM 0 HA LEU B 183 -1.460 8.810 6.892 1.00 0.00 H new ATOM 0 HB2 LEU B 183 -2.864 10.383 4.717 1.00 0.00 H new ATOM 0 HB3 LEU B 183 -1.298 9.675 4.377 1.00 0.00 H new ATOM 0 HG LEU B 183 -3.629 8.083 5.549 1.00 0.00 H new ATOM 0 HD11 LEU B 183 -3.920 7.193 3.246 1.00 0.00 H new ATOM 0 HD12 LEU B 183 -4.192 8.951 3.293 1.00 0.00 H new ATOM 0 HD13 LEU B 183 -2.660 8.305 2.660 1.00 0.00 H new ATOM 0 HD21 LEU B 183 -2.290 6.119 4.837 1.00 0.00 H new ATOM 0 HD22 LEU B 183 -1.003 7.203 4.257 1.00 0.00 H new ATOM 0 HD23 LEU B 183 -1.387 7.127 5.993 1.00 0.00 H new ATOM 3066 N ASP B 184 -0.919 12.043 6.515 1.00 0.00 N ATOM 3067 CA ASP B 184 0.116 13.057 6.616 1.00 0.00 C ATOM 3068 C ASP B 184 0.703 13.081 8.023 1.00 0.00 C ATOM 3069 O ASP B 184 1.901 13.297 8.207 1.00 0.00 O ATOM 3070 CB ASP B 184 -0.474 14.431 6.261 1.00 0.00 C ATOM 3071 CG ASP B 184 0.603 15.343 5.676 1.00 0.00 C ATOM 3072 OD1 ASP B 184 0.897 15.199 4.501 1.00 0.00 O ATOM 3073 OD2 ASP B 184 1.114 16.170 6.412 1.00 0.00 O ATOM 0 H ASP B 184 -1.863 12.406 6.382 1.00 0.00 H new ATOM 0 HA ASP B 184 0.917 12.819 5.916 1.00 0.00 H new ATOM 0 HB2 ASP B 184 -1.285 14.310 5.543 1.00 0.00 H new ATOM 0 HB3 ASP B 184 -0.903 14.890 7.152 1.00 0.00 H new ATOM 3078 N GLU B 185 -0.154 12.847 9.013 1.00 0.00 N ATOM 3079 CA GLU B 185 0.286 12.833 10.404 1.00 0.00 C ATOM 3080 C GLU B 185 1.143 11.602 10.691 1.00 0.00 C ATOM 3081 O GLU B 185 2.173 11.693 11.355 1.00 0.00 O ATOM 3082 CB GLU B 185 -0.927 12.847 11.333 1.00 0.00 C ATOM 3083 CG GLU B 185 -1.680 14.171 11.176 1.00 0.00 C ATOM 3084 CD GLU B 185 -0.861 15.316 11.760 1.00 0.00 C ATOM 3085 OE1 GLU B 185 -0.466 15.211 12.911 1.00 0.00 O ATOM 3086 OE2 GLU B 185 -0.640 16.286 11.052 1.00 0.00 O ATOM 0 H GLU B 185 -1.149 12.666 8.880 1.00 0.00 H new ATOM 0 HA GLU B 185 0.890 13.723 10.582 1.00 0.00 H new ATOM 0 HB2 GLU B 185 -1.587 12.012 11.098 1.00 0.00 H new ATOM 0 HB3 GLU B 185 -0.607 12.720 12.367 1.00 0.00 H new ATOM 0 HG2 GLU B 185 -1.882 14.360 10.122 1.00 0.00 H new ATOM 0 HG3 GLU B 185 -2.645 14.111 11.680 1.00 0.00 H new ATOM 3093 N ALA B 186 0.706 10.452 10.185 1.00 0.00 N ATOM 3094 CA ALA B 186 1.435 9.205 10.397 1.00 0.00 C ATOM 3095 C ALA B 186 2.825 9.278 9.769 1.00 0.00 C ATOM 3096 O ALA B 186 3.798 8.790 10.340 1.00 0.00 O ATOM 3097 CB ALA B 186 0.658 8.040 9.780 1.00 0.00 C ATOM 0 H ALA B 186 -0.144 10.358 9.629 1.00 0.00 H new ATOM 0 HA ALA B 186 1.543 9.048 11.470 1.00 0.00 H new ATOM 0 HB1 ALA B 186 1.206 7.112 9.941 1.00 0.00 H new ATOM 0 HB2 ALA B 186 -0.323 7.968 10.249 1.00 0.00 H new ATOM 0 HB3 ALA B 186 0.537 8.209 8.710 1.00 0.00 H new